Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A1 | P30531 | 4/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL8103609 | 0.84 | ALDH1A1 (0.62) | L3MBTL1ALDH1A1 | |
| SCHEMBL5841484 | 0.81 | L3MBTL1 (0.54) | L3MBTL1CYP2D6CYP2C19 | |
| SCHEMBL31148136 | 0.80 | DRD3 (0.55) | ALDH1A1LMNATSHRHSD17B10 | |
| SCHEMBL31148132 | 0.80 | DRD3 (0.55) | ALDH1A1LMNATSHRHSD17B10 | |
| SCHEMBL21061969 | 0.79 | L3MBTL1 (0.82) | L3MBTL1ALDH1A1LMNACYP2D6CYP2C9 | |
| SCHEMBL21061629 | 0.79 | L3MBTL1 (0.82) | L3MBTL1ALDH1A1LMNACYP2D6CYP2C9 | |
| SCHEMBL4498993 | 0.78 | ALDH1A1 (0.53) | L3MBTL1ALDH1A1CYP2C9 | |
| SCHEMBL8983766 | 0.77 | ATM (0.54) | L3MBTL1CYP2D6TSHRNFKB1 | |
| SCHEMBL868571 | 0.76 | HRH3 (0.56) | ALDH1A1CYP1A2CYP2D6HSD17B10 | |
| SCHEMBL30370085 | 0.76 | L3MBTL1 (0.72) | L3MBTL1ALDH1A1LMNACYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6127366-A | ANTICARCINOGENIC OR ANTITUMOR AGENTS | MERCK & CO., INC. (US) | 2000-10-03 | — | — | US | disclosed |
| EP-0862435-A4 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO INC (US) | 1999-02-03 | — | — | EP | disclosed |
| US-5817678-A | IMIDAZOLE-CONTAINING PIPERIDINE DERIVATIVES, PEPTIDEMIMETIC | MERCK & CO., INC. (US) | 1998-10-06 | — | — | US | disclosed |
| EP-0862435-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | Merck & Co., Inc. (US) | 1998-09-09 | — | — | EP | disclosed |
| WO-1997018813-A1 | INHIBITORS OF FARNESYL-PROTEIN TRANSFERASE | MERCK & CO., INC. (US) | 1997-05-29 | — | — | WO | disclosed |