Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 4/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ASPH | Q12797 | 1/20 | 0.52 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CASP7 | P55210 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.46 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.46 |
| ▸ | AKR1C1 | Q04828 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27789807 | 0.84 | KCNMA1 (0.47) | AKR1C3AKR1C2MEN1KMT2AGAA | |
| SCHEMBL1496043 | 0.84 | ALDH1A1 (0.48) | MEN1KMT2AGAAMAPK1TDP1 | |
| SCHEMBL30933991 | 0.84 | ALDH1A1 (0.48) | MEN1KMT2AGAAMAPK1TDP1 | |
| SCHEMBL1495983 | 0.83 | L3MBTL1 (0.50) | AKR1C3AKR1C2MEN1KMT2AALDH1A1 | |
| SCHEMBL27789698 | 0.82 | MEN1 (0.41) | AKR1C3AKR1C2MEN1KMT2AGAA | |
| SCHEMBL27540751 | 0.81 | KDM4E (0.48) | AKR1C3AKR1C2KDM4EASPHKDM8 | |
| SCHEMBL29989671 | 0.80 | MAPK1 (0.47) | KDM4EASPHKDM8MEN1KMT2A | |
| SCHEMBL21378896 | 0.80 | MAPK1 (0.47) | KDM4EASPHKDM8MEN1KMT2A | |
| SCHEMBL1495855 | 0.79 | CDC25B (0.46) | KDM4EMEN1KMT2AGAAMAPK1 | |
| SCHEMBL5554094 | 0.79 | CDC25B (0.45) | MEN1KMT2AGAAMAPK1TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102617580-B | Vasopressin v1a antagonists | VANTIA LTD | 2015-03-04 | — | — | CN | disclosed |
| CN-102617580-A | Vasopressin V1a Antagonists | FERRING BV | 2012-08-01 | — | — | CN | disclosed |
| CN-101563347-A | Vasopressin V1a antagonists | VANTIA LTD (GB) | 2009-10-21 | — | — | CN | disclosed |