Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 3/20 | 0.49 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | APEX1 | P27695 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD1 | P21728 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11206777 | 0.87 | ADRB2 (0.45) | ADRB2OPRM1MEN1MAPTKMT2A | |
| SCHEMBL11239304 | 0.86 | MEN1 (0.41) | MEN1MAPTKMT2AALDH1A1CYP2D6 | |
| SCHEMBL11006874 | 0.86 | MEN1 (0.41) | MEN1MAPTKMT2AALDH1A1CYP2D6 | |
| SCHEMBL11240757 | 0.86 | MEN1 (0.41) | MEN1MAPTKMT2AALDH1A1CYP2D6 | |
| Hydrochloric Acid SCHEMBL11246213 | 0.85 | MEN1 (0.40) | OPRM1MEN1MAPTKMT2AALDH1A1 | |
| SCHEMBL20131098 | 0.77 | ADRB2 (0.56) | ADRB2OPRM1CYP2D6 | |
| SCHEMBL11272560 | 0.76 | ALDH1A1 (0.42) | MEN1MAPTKMT2AALDH1A1CYP2D6 | |
| SCHEMBL11236653 | 0.76 | CYP2D6 (0.39) | MEN1MAPTKMT2AALDH1A1CYP2D6 | |
| SCHEMBL11260060 | 0.76 | HTR2A (0.42) | MEN1MAPTKMT2AALDH1A1CYP2D6 | |
| SCHEMBL10814023 | 0.75 | MEN1 (0.46) | MEN1MAPTKMT2AALDH1A1CYP2D6 |
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-4335135-A | 5 Amino-3,4,5,6 tetrahydro-1H-[-6-]cyclohept[c,d]indolols and a method for their use as hypotensives | ROUSSEL UCLAF (FR) | 1982-06-15 | — | — | US | disclosed |