Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Tricarballylic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 4/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | SLC22A16 | Q86VW1 | 1/20 | 0.39 |
| ▸ | CPT2 | P23786 | 1/20 | 0.36 |
| ▸ | CPT1A | P50416 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Tricarballylic Acid SCHEMBL4898296 | 0.94 | CA4 (0.57) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL29165746 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL11318639 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL8979864 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL11318645 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL30504723 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL6757050 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL28977121 | 0.94 | CA4 (0.52) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL11734298 | 0.89 | CA4 (0.44) | CA4CTSLCA2CYP3A4TSHR | |
| Tricarballylic Acid SCHEMBL2462502 | 0.84 | CA4 (0.44) | CA4CTSLCA2CYP3A4TSHR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4200586-A | Inhibiting the carbon-carbon double bond isomerization of substituted or unsubstituted hydrocarbon compounds | PHILLIPS PETROLEUM COMPANY (US) | 1980-04-29 | — | — | US | claimed |
| US-5872111-A | TOILET BAR SOAP, FACIAL BODY CLEANSER, SHAMPOO, CONDITIONER, COSMETIC,SHAVING CREAM OR LOTION, SHOWER GEL, FABRIC SOFTENING CONDITIONER, AND UNDERARM DEODORANT/ANTI-PERSPIRANT | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1999-02-16 | — | — | US | disclosed |
| US-5844103-A | Anionic glycasuccinamide sufactants and a process for their manufacture | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1998-12-01 | — | — | US | disclosed |
| US-5786468-A | NONIONIC SURFACTANTS DERIVED FROM CARBOHYDRATES FOR SHAMPOO, DEODORANTS OR CLEANING COMPOUNDS | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1998-07-28 | — | — | US | disclosed |
| US-5750733-A | Hydroxy containing alkyl glycamides, low foaming detergent compositions comprising such and a process for their manufacture | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1998-05-12 | — | — | US | disclosed |
| US-5631389-A | SUCCINAMIDES WITH SUGAR GROUPS, POLLUTION CONTROL, BIODEGRADABLE | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1997-05-20 | — | — | US | disclosed |
| US-5541341-A | CARBOHYDRATE BASED SURFACTANTS | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1996-07-30 | — | — | US | disclosed |
| US-5521293-A | Heteroatom containing alkyl aldonamide compounds as superior foaming, more soluble nonionic surfactants and a process for their manufacture | LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) | 1996-05-28 | — | — | US | disclosed |
| US-4200586-A | Inhibiting the carbon-carbon double bond isomerization of substituted or unsubstituted hydrocarbon compounds | PHILLIPS PETROLEUM COMPANY (US) | 1980-04-29 | — | — | US | disclosed |