Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | DTYMK | P23919 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP6 | P55212 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | SLC25A1 | P53007 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL801584 | 0.86 | DTYMK (0.46) | POLBL3MBTL1DTYMKTSHRCASP6 | |
| Nitrous Acid SCHEMBL29105411 | 0.81 | DTYMK (0.45) | POLBL3MBTL1DTYMKTSHRCASP6 | |
| SCHEMBL1561505 | 0.81 | POLB (0.47) | POLBL3MBTL1VCAM1MAPTTDP1 | |
| SCHEMBL16333727 | 0.79 | POLB (0.46) | POLBL3MBTL1DTYMKTSHRCASP6 | |
| SCHEMBL12489778 | 0.76 | TSHR (0.44) | POLBTSHRALDH1A1VCAM1MAPT | |
| SCHEMBL979398 | 0.75 | NAPRT (0.47) | TSHRALDH1A1NAPRTCYP3A4HPGD | |
| SCHEMBL29773884 | 0.75 | NAPRT (0.47) | TSHRALDH1A1NAPRTCYP3A4HPGD | |
| SCHEMBL11697530 | 0.75 | DTYMK (0.60) | DTYMKTSHRCASP6ALDH1A1MAPT | |
| SCHEMBL30287096 | 0.75 | CA12 (0.43) | POLBL3MBTL1CYP1A2CYP2C19VCAM1 | |
| SCHEMBL30287108 | 0.75 | CYP3A4 (0.45) | POLBALDH1A1VCAM1MAPTGPR35 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2358202-A1 | BENZIMIDAZOLE AND AZA-BENZIMIDAZOLE CARBOXAMIDES | Merck Sharp & Dohme Corp. (US) | 2011-08-24 | — | — | EP | disclosed |
| WO-2010051245-A1 | BENZIMIDAZOLE AND AZA-BENZIMIDAZOLE CARBOXAMIDES | MERCK SHARP & DOHME CORP. (US) | 2010-05-06 | — | — | WO | disclosed |