Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 16/20 | 0.69 |
| ▸ | CYP11B2 | P19099 | 16/20 | 0.69 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.58 |
| ▸ | FNTA | P49354 | 2/20 | 0.53 |
| ▸ | FNTB | P49356 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL6708657 | 0.86 | CYP11B1 (0.72) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL7818410 | 0.85 | CYP11B1 (0.70) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL3824590 | 0.82 | CYP11B1 (1.00) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL7166994 | 0.80 | CYP11B2 (0.46) | CYP11B1CYP11B2FNTAFNTB | |
| Lithium Ion SCHEMBL8437833 | 0.79 | CYP11B1 (0.67) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL8182963 | 0.77 | CYP11B1 (0.61) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL2786255 | 0.76 | CYP11B1 (0.71) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Hydrochloric Acid SCHEMBL8481395 | 0.75 | CYP11B1 (0.69) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| Bromide SCHEMBL7927507 | 0.75 | CYP11B1 (0.69) | CYP11B1CYP11B2CYP19A1FNTAFNTB | |
| SCHEMBL7478451 | 0.75 | CYP11B1 (0.69) | CYP11B1CYP11B2CYP19A1FNTAFNTB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001017992-A1 | INHIBITORS OF PRENYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 2001-03-15 | — | — | WO | disclosed |
| US-6103723-A | INHIBIT FARNESYL-PROTEIN TRANSFERASE (FTASE) AND THE FARNESYLATION OF THE ONCOGENE PROTEIN RAS; ANTICARCINOGENIC AGENTS; CONFORMATIONALLY CONSTRAINED COMPOUNDS THAT DO NOT HAVE A THIOL MOIETY; INHIBITION OF POST-TRANSLATIONAL | MERCK & CO., INC. (US) | 2000-08-15 | — | — | US | disclosed |