Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.55 |
| ▸ | RAB9A | P51151 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 5/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | KCNMA1 | Q12791 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8319324 | 0.88 | RAB9A (0.64) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL8317818 | 0.88 | HDAC1 (0.51) | ALDH1A1KDM4ERAB9ACYP1A2MAPT | |
| SCHEMBL7334998 | 0.87 | ALDH1A1 (0.65) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL8319629 | 0.87 | RAB9A (0.51) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL7336012 | 0.86 | MEN1 (0.55) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL8317200 | 0.84 | RAB9A (0.54) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL7367123 | 0.84 | RAB9A (0.57) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL8317169 | 0.83 | ALDH1A1 (0.67) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL6961250 | 0.83 | ALDH1A1 (0.54) | ALDH1A1KDM4ERAB9ACYP1A2GAA | |
| SCHEMBL8316866 | 0.83 | RAB9A (0.56) | ALDH1A1KDM4ERAB9ACYP1A2GAA |
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-0636625-B1 | Tricyclic diazepines vasopressin and oxytocin antagonists | AMERICAN CYANAMID CO (US) | 1999-01-27 | — | — | EP | disclosed |
| CN-1106812-A | Tricyclic diaza * vasopressin antagonists and oxytocin antagonists | AMERICAN CYANAMID CO (US) | 1995-08-16 | — | — | CN | disclosed |