Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of P-Anisic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | RXRA | P19793 | 1/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | TAS2R14 | Q9NYV8 | 2/20 | 0.48 |
| ▸ | STS | P08842 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | PTGES | O14684 | 1/20 | 0.46 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.46 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Potassium Ion SCHEMBL29026645 | 0.84 | CTSD (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2HTT | |
| P-Anisic Acid SCHEMBL28313270 | 0.81 | CA1 (0.78) | CA1CA2ALDH1A1RXRACES2 | |
| SCHEMBL2514158 | 0.81 | CTSD (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2HTT | |
| SCHEMBL1333594 | 0.81 | CTSD (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2HTT | |
| Zinc Ion SCHEMBL10404876 | 0.81 | CTSD (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2HTT | |
| Lithium Ion SCHEMBL7961800 | 0.81 | CTSD (0.56) | ALDH1A1NPC1RAB9ASMN1; SMN2HTT | |
| P-Anisic Acid SCHEMBL27338972 | 0.79 | CA1 (0.95) | CA1CA2ALDH1A1RXRACES2 | |
| P-Anisic Acid SCHEMBL2418188 | 0.78 | ALDH1A1 (0.53) | CA1CA2ALDH1A1RXRACES2 | |
| SCHEMBL8439039 | 0.78 | ALDH1A1 (0.64) | ALDH1A1RXRASTSNPC1RAB9A | |
| SCHEMBL1682193 | 0.78 | STS (0.70) | ALDH1A1CES2CES1STSNPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110156733-A | A kind of tyrosinase inhibitor and its application | 润和生物医药科技(汕头)有限公司 | 2019-08-23 | — | — | CN | disclosed |