Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6499398 | 0.89 | NPC1 (0.47) | NPC1RAB9AMAOBPOLBCAPN1 | |
| SCHEMBL6532940 | 0.89 | NPC1 (0.47) | NPC1RAB9AMAOBPOLBCAPN1 | |
| SCHEMBL6505746 | 0.83 | NPC1 (0.44) | NPC1RAB9ACAPN1KDM4EMAPT | |
| SCHEMBL6505741 | 0.83 | NPC1 (0.44) | NPC1RAB9ACAPN1KDM4EMAPT | |
| SCHEMBL6498265 | 0.80 | NPC1 (0.48) | NPC1RAB9ACAPN1KDM4EALDH1A1 | |
| SCHEMBL6498264 | 0.80 | NPC1 (0.48) | NPC1RAB9ACAPN1KDM4EALDH1A1 | |
| SCHEMBL6497650 | 0.78 | NPC1 (0.60) | NPC1RAB9AMAOBPOLBCAPN1 | |
| SCHEMBL6500473 | 0.78 | SMN1; SMN2 (0.66) | NPC1RAB9APOLBCAPN1KMT2A | |
| SCHEMBL6496329 | 0.78 | SMN1; SMN2 (0.55) | NPC1RAB9APOLBCAPN1KMT2A | |
| SCHEMBL6500476 | 0.78 | SMN1; SMN2 (0.66) | NPC1RAB9APOLBCAPN1KMT2A |
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-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |