Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6293568 | 0.81 | POLB (0.61) | NPC1RAB9AMEN1KMT2ACHRM2 | |
| SCHEMBL13189052 | 0.79 | NPC1 (0.55) | NPC1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL13189047 | 0.76 | DPP4 (0.49) | NPC1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL12249655 | 0.75 | ACE (0.56) | CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL6593007 | 0.74 | CHRM2 (0.46) | CHRM2CHRM4CHRM1CHRM3 | |
| SCHEMBL3427333 | 0.74 | POLB (0.52) | CHRM2CHRM4CHRM1CHRM3DPP4 | |
| SCHEMBL3431495 | 0.74 | POLB (0.52) | CHRM2CHRM4CHRM1CHRM3DPP4 | |
| SCHEMBL5046477 | 0.74 | POLB (0.52) | CHRM2CHRM4CHRM1CHRM3DPP4 | |
| SCHEMBL770682 | 0.72 | DPP7 (0.48) | NPC1RAB9ADPP4 | |
| SCHEMBL15808670 | 0.71 | POLB (0.58) | CHRM2CHRM4CHRM1CHRM3DPP4 |
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-1344256-A | (Hetero) aryl-bicyclic heteroaryl derivatives, their prepn. and their use as protease inhibitors | AXYS PHARM INC (US) | 2002-04-10 | — | — | CN | disclosed |