Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 11/20 | 0.71 |
| ▸ | NPC1 | O15118 | 11/20 | 0.71 |
| ▸ | RAB9A | P51151 | 10/20 | 0.71 |
| ▸ | STAT1 | P42224 | 1/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | ACP1 | P24666 | 1/20 | 0.64 |
| ▸ | TP53 | P04637 | 3/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.64 |
| ▸ | RELA | Q04206 | 1/20 | 0.64 |
| ▸ | MAPT | P10636 | 5/20 | 0.63 |
| ▸ | USP2 | O75604 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.62 |
| ▸ | ALPL | P05186 | 1/20 | 0.61 |
| ▸ | SCD | O00767 | 1/20 | 0.55 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6057541 | 0.83 | NPC1 (1.00) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL18585932 | 0.81 | NPC1 (0.77) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL6057632 | 0.81 | LCK (0.72) | KMT2A | |
| SCHEMBL14808429 | 0.80 | SMN1; SMN2 (0.77) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL11303998 | 0.80 | NPC1 (0.80) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL4746072 | 0.80 | NPC1 (0.77) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL28878441 | 0.78 | NPC1 (0.74) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL29973978 | 0.78 | NPC1 (0.74) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 | |
| SCHEMBL13189051 | 0.78 | KMT2A (0.74) | SMN1; SMN2NPC1RAB9AALDH1A1KMT2A | |
| SCHEMBL6057496 | 0.78 | NPC1 (0.73) | SMN1; SMN2NPC1RAB9ASTAT1ALDH1A1 |
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-1037632-B1 | BENZOTHIAZOLE PROTEIN TYROSINE KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2006-01-11 | — | — | EP | disclosed |
| US-6825355-B2 | FOR THERAPY OF IMMUNOLOGIC DISORDERS SUCH AS TRANSPLANT REJECTION, RHEUMATOID ARTHRITIS. MULTIPLE SCLEROSIS, INFLAMMATORY BOWEL DISEASE, LUPUS, GRAFT VS. HOST DISEASE | BRISTOL-MYERS SQUIBB CO. | 2004-11-30 | — | — | US | disclosed |