Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | ERG | P11308 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8101292 | 0.93 | MEN1 (0.36) | GPBAR1CHRM2CHRM5CHRM1CYP2C9 | |
| SCHEMBL8095399 | 0.89 | CYP3A4 (0.44) | L3MBTL1CHRM2CHRM5CHRM1CYP2C9 | |
| SCHEMBL446561 | 0.87 | ALOX12 (0.40) | GPBAR1L3MBTL1ALOX12ERG | |
| SCHEMBL8097381 | 0.87 | KDM4E (0.45) | GPBAR1ERGGAACYP2C9 | |
| SCHEMBL8097934 | 0.86 | KMT2A (0.46) | ALOX12 | |
| SCHEMBL8095905 | 0.86 | GSK3B (0.38) | GPBAR1L3MBTL1ALOX12ERGTSHR | |
| SCHEMBL8097933 | 0.86 | GPBAR1 (0.42) | GPBAR1ERGGAAMAPTCYP2C9 | |
| SCHEMBL8088441 | 0.85 | ALDH1A1 (0.43) | NPSR1GAAMAPTCYP2C9 | |
| SCHEMBL8095367 | 0.84 | KDM4E (0.45) | GAAMAPTCYP2C9 | |
| SCHEMBL8088418 | 0.84 | CYP2C9 (0.40) | GPBAR1ALOX12ERGCYP2C9 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0862435-A4 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 1999-02-03 | — | — | EP | claimed |
| EP-0862435-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 1998-09-09 | — | — | EP | claimed |
| WO-1997018813-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1997-05-29 | — | — | WO | claimed |
| US-6127366-A | ANTICARCINOGENIC OR ANTITUMOR AGENTS | MERCK & CO., INC. (US) | 2000-10-03 | — | — | US | disclosed |
| US-5817678-A | IMIDAZOLE-CONTAINING PIPERIDINE DERIVATIVES, PEPTIDEMIMETIC | MERCK & CO., INC. (US) | 1998-10-06 | — | — | US | disclosed |