Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | NPC1 | O15118 | 3/20 | 0.66 |
| ▸ | BRD4 | O60885 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | CTSV | O60911 | 1/20 | 0.40 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.40 |
| ▸ | TUBB | P07437 | 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 | |
|---|---|---|---|---|
| SCHEMBL13568570 | 0.80 | ALDH1A1 (0.49) | RAB9ANPC1KDM4EHPGDLMNA | |
| SCHEMBL27642153 | 0.79 | NPC1 (0.68) | RAB9ANPC1BRD4KDM4EHPGD | |
| SCHEMBL15572536 | 0.79 | NPC1 (1.00) | RAB9ANPC1KDM4EHPGDHSD17B10 | |
| SCHEMBL7329075 | 0.74 | RAB9A (0.51) | RAB9ANPC1BRD4KDM4EHPGD | |
| SCHEMBL21757291 | 0.74 | BRD4 (0.55) | RAB9ANPC1BRD4KDM4EHPGD | |
| SCHEMBL16976741 | 0.72 | PDE4A (0.55) | RAB9ANPC1BRD4KDM4EHPGD | |
| SCHEMBL11016316 | 0.71 | BRD4 (0.56) | RAB9ANPC1BRD4KDM4EHPGD | |
| SCHEMBL6957694 | 0.71 | BRD4 (0.56) | RAB9ANPC1BRD4KDM4EHPGD | |
| SCHEMBL2215320 | 0.70 | BRD4 (0.75) | BRD4KDM4EMAPTALDH1A1TAS2R38 | |
| SCHEMBL24697352 | 0.69 | BRD4 (0.54) | RAB9ANPC1BRD4KDM4EHPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009148004-A1 | NOVEL COMPOUND AND PHARMACEUTICAL APPLICATION OF SAME | 株式会社 三和化学研究所 (JP) | 2009-12-10 | — | — | WO | disclosed |
| US-5545645-A | Heterocyclic derivatives in the treatment of ischaemia and related diseases | SYNTEX PHARMACEUTICALS, LIMITED (GB) | 1996-08-13 | — | — | US | disclosed |
| EP-0693062-A1 | HETEROCYCLIC DERIVATIVES IN THE TREATMENT OF ISCHAEMIA AND RELATED DISEASES | SYNTEX PHARMACEUTICALS LTD. (GB) | 1996-01-24 | — | — | EP | disclosed |
| US-5428037-A | Piperazine derivatives; calcium and sodium channel antagonists | SYNTEX PHARMACEUTICALS, LTD. (GB) | 1995-06-27 | — | — | US | disclosed |
| WO-1994024116-A1 | HETEROCYCLIC DERIVATIVES IN THE TREATMENT OF ISCHAEMIA AND RELATED DISEASES | SYNTEX PHARMACEUTICALS LIMITED (GB) | 1994-10-27 | — | — | WO | disclosed |