Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR6 | P46095 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.31 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | RAD52 | P43351 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | CBX7 | O95931 | 1/20 | 0.30 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8637529 | 0.90 | AVPR2 (0.40) | GPR6RAB9APTPN1AVPR2AVPR1A | |
| SCHEMBL7476396 | 0.81 | CBX7 (0.31) | CNR2CBX7 | |
| Hydrochloric Acid SCHEMBL7592049 | 0.80 | CBX7 (0.32) | ALDH1A1CBX7 | |
| SCHEMBL7778674 | 0.79 | KMT2A (0.42) | RAB9AAVPR2AVPR1AALDH1A1KDM4E | |
| SCHEMBL7598082 | 0.79 | HRH4 (0.35) | DRD3 | |
| SCHEMBL7341409 | 0.78 | DRD2 (0.33) | GPR6RAB9AAVPR2AVPR1ADRD3 | |
| SCHEMBL7781332 | 0.77 | KMT2A (0.39) | RAB9AAVPR2AVPR1AALDH1A1KDM4E | |
| SCHEMBL7340721 | 0.76 | AVPR2 (0.39) | RAB9AAVPR2AVPR1ACDK1ALDH1A1 | |
| SCHEMBL7476543 | 0.75 | — | — | |
| SCHEMBL7478475 | 0.74 | CBX7 (0.38) | RAB9AAVPR2AVPR1AALDH1A1KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0832061-A1 | BENZAMIDE DERIVATIVES AND THEIR USE AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1998-04-01 | — | — | EP | disclosed |