Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MMP1 | P03956 | 5/20 | 0.46 |
| ▸ | MMP9 | P14780 | 5/20 | 0.46 |
| ▸ | MMP13 | P45452 | 5/20 | 0.46 |
| ▸ | MMP2 | P08253 | 5/20 | 0.46 |
| ▸ | MMP8 | P22894 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 3/20 | 0.42 |
| ▸ | PDE4A | P27815 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7364753 | 0.80 | ALDH1A1 (0.49) | ALDH1A1MMP1MMP9MMP13MMP2 | |
| SCHEMBL30937671 | 0.76 | ALDH1A1 (0.57) | ALDH1A1SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL3306459 | 0.72 | ALDH1A1 (0.49) | ALDH1A1MMP1MMP9MMP13MMP2 | |
| SCHEMBL5595476 | 0.69 | CYP1A2 (0.56) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A | |
| SCHEMBL5583370 | 0.68 | ALDH1A1 (0.52) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A | |
| SCHEMBL6608055 | 0.68 | MMP1 (0.80) | MMP1MMP9MMP13MMP2MMP8 | |
| SCHEMBL28254105 | 0.68 | ALDH1A1 (0.72) | ALDH1A1SMN1; SMN2RAB9AKMT2AMAPT | |
| SCHEMBL28569559 | 0.67 | SMN1; SMN2 (0.51) | ALDH1A1MMP13HPGDSMN1; SMN2NPC1 | |
| SCHEMBL5853954 | 0.67 | ALDH1A1 (0.58) | ALDH1A1HPGDSMN1; SMN2RAB9AKMT2A | |
| SCHEMBL7255311 | 0.67 | ALDH1A1 (0.55) | ALDH1A1HPGDSMN1; SMN2NPC1RAB9A |
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-1147095-A1 | 2, 3, 4, 5-TETRAHYDRO-1H-[1, 4] BENZODIAZEPINE-3-HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASE INHIBITORS | American Cyanamid Company (US) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000044730-A1 | 2,3,4,5-TETRAHYDRO-1H-[1,4]BENZODIAZEPINE-3-HYDROXAMIC ACID AS MATRIX METALLOPROTEINASE INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 2000-08-03 | — | — | WO | disclosed |