Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.62 |
| ▸ | RAB9A | P51151 | 3/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | AURKA | O14965 | 2/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | FGFR1 | P11362 | 6/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL2340937 | 0.82 | NPC1 (0.59) | NPC1RAB9ASMN1; SMN2FGFR1HPGD | |
| SCHEMBL1761988 | 0.80 | GABRA1 (0.56) | NPC1RAB9ASMN1; SMN2AURKAAURKB | |
| SCHEMBL2653352 | 0.79 | NPC1 (0.53) | NPC1RAB9ASMN1; SMN2AURKAAURKB | |
| SCHEMBL2641981 | 0.78 | FGFR1 (0.56) | SMN1; SMN2AURKAAURKBKDRFGFR1 | |
| SCHEMBL7989436 | 0.78 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2FGFR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL2641992 | 0.77 | FGFR1 (0.54) | SMN1; SMN2AURKAAURKBKDRFGFR1 | |
| Diethylamine SCHEMBL2642037 | 0.77 | KDR (0.48) | NPC1RAB9ASMN1; SMN2KDRFGFR1 | |
| Hydrochloric Acid SCHEMBL7976246 | 0.77 | NPC1 (0.97) | NPC1RAB9ASMN1; SMN2FGFR1ALDH1A1 | |
| SCHEMBL4503339 | 0.76 | NPC1 (0.70) | NPC1RAB9ASMN1; SMN2FGFR1ALDH1A1 | |
| SCHEMBL2642007 | 0.76 | HPGD (0.49) | NPC1RAB9ASMN1; SMN2AURKAAURKB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0563001-B1 | Imidazole compounds, their preparation and use | NEUROSEARCH AS (DK) | 1996-02-28 | — | — | EP | disclosed |
| US-5360809-A | Imidazole compounds and their use as calcium channel blockers | NEUROSEARCH A/S (DK) | 1994-11-01 | — | — | US | disclosed |
| EP-0563001-A1 | Imidazole compounds, their preparation and use | NEUROSEARCH A/S (DK) | 1993-09-29 | — | — | EP | disclosed |