Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8140892 | 0.91 | PKM (0.52) | PKMHSD17B10NPC1RAB9ARXFP1 | |
| SCHEMBL4196712 | 0.84 | PKM (0.67) | PKMHSD17B10NPC1RAB9ARXFP1 | |
| SCHEMBL14686859 | 0.80 | PKM (0.63) | PKMHSD17B10NPC1RAB9ARXFP1 | |
| SCHEMBL5515479 | 0.79 | MAPT (0.51) | NPC1RAB9AHPGDTSHRLMNA | |
| SCHEMBL25236156 | 0.79 | PKM (0.62) | PKMHSD17B10NPC1RAB9ARXFP1 | |
| SCHEMBL8134923 | 0.78 | HPGD (0.50) | NPC1RAB9ARXFP1HPGDTSHR | |
| SCHEMBL7431121 | 0.76 | HTT (0.57) | PKMHSD17B10NPC1RAB9ARXFP1 | |
| SCHEMBL8143968 | 0.75 | ALDH1A1 (0.47) | NPC1RAB9ARXFP1HPGDTSHR | |
| SCHEMBL8144130 | 0.75 | ATM (0.52) | NPC1RAB9ARXFP1HPGDTSHR | |
| SCHEMBL8135805 | 0.75 | ALDH1A1 (0.65) | HPGDTSHRLMNAALDH1A1HTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6100272-A | Tetracyclic spiro compounds as 5HT1B receptor antagonists | SMITHKLINE BEECHAM P.L.C. (GB) | 2000-08-08 | — | — | US | disclosed |
| EP-0888358-A1 | PIPERIDINE DERIVATIVES | SMITHKLINE BEECHAM PLC (GB) | 1999-01-07 | — | — | EP | disclosed |
| WO-1997034901-A1 | PIPERIDINE DERIVATIVES | SMITHKLINE BEECHAM P.L.C. (GB) | 1997-09-25 | — | — | WO | disclosed |