Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UTS2R | Q9UKP6 | 8/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8593273 | 0.87 | UTS2R (0.56) | UTS2RKDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL8594648 | 0.84 | TACR1 (0.42) | UTS2RMEN1KMT2ASMN1; SMN2RIPK1 | |
| SCHEMBL8589975 | 0.83 | RIPK1 (0.41) | UTS2RKDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL8592265 | 0.81 | UTS2R (0.50) | UTS2RKDM4EMEN1ALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL8591692 | 0.75 | HTR1A (0.49) | OPRK1SLC6A4 | |
| SCHEMBL8590156 | 0.74 | SLC6A2 (0.45) | KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8591080 | 0.73 | SLC6A2 (0.44) | KDM4EALDH1A1SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL8593270 | 0.72 | UTS2R (0.47) | UTS2ROPRK1TACR1CYP2C9CYP2C19 | |
| SCHEMBL8589466 | 0.71 | TACR1 (0.46) | UTS2ROPRK1CYP3A4CYP2D6TACR1 | |
| SCHEMBL8590158 | 0.71 | SLC6A2 (0.53) | KDM4EMEN1ALDH1A1KMT2ASMN1; SMN2 |
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-5770735-A | Polycyclic amine compounds and their enantiomers, their method of preparation and pharmaceutical compositions in which they are present | ELF SANOFI (FR) | 1998-06-23 | — | — | US | disclosed |