Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 4/20 | 0.44 |
| ▸ | AVPR1A | P37288 | 4/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.41 |
| ▸ | SPTLC2 | O15270 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | GLP1R | P43220 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8635106 | 0.91 | AVPR2 (0.43) | AVPR2AVPR1AHSD11B1CHRM1ABCB11 | |
| SCHEMBL8627201 | 0.91 | AVPR1A (0.46) | AVPR2AVPR1AHSD11B1SPTLC2CHRM1 | |
| SCHEMBL8628513 | 0.90 | AVPR1A (0.44) | AVPR2AVPR1AHSD11B1SPTLC2CHRM1 | |
| Hydrochloric Acid SCHEMBL8634418 | 0.87 | AVPR2 (0.41) | AVPR2AVPR1AHSD11B1SPTLC2CHRM1 | |
| SCHEMBL8630871 | 0.86 | AVPR2 (0.44) | AVPR2AVPR1AHSD11B1CHRM1ABCB11 | |
| Hydrochloric Acid SCHEMBL8634086 | 0.85 | AVPR2 (0.43) | AVPR2AVPR1AHSD11B1CHRM1ABCB11 | |
| SCHEMBL8627097 | 0.85 | SPTLC2 (0.51) | AVPR2AVPR1AHSD11B1SPTLC2CHRM1 | |
| SCHEMBL8629370 | 0.85 | CHRM1 (0.48) | AVPR2AVPR1AHSD11B1CHRM1ABCB11 | |
| SCHEMBL8632047 | 0.85 | AVPR2 (0.43) | AVPR2AVPR1AHSD11B1CHRM1ABCB11 | |
| SCHEMBL8628769 | 0.82 | AVPR2 (0.40) | AVPR2AVPR1AHSD11B1SPTLC2CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5753644-A | Vasopressin antagonist and oxytocin antagonist | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1998-05-19 | — | — | US | disclosed |