Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9499951 | 0.74 | GPR3 (0.47) | ALDH1A1KDM4EMAPTGAAGLA | |
| SCHEMBL10766740 | 0.72 | CYP2D6 (0.49) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL17616023 | 0.71 | GPR3 (0.52) | ALDH1A1KDM4EMAPTGAAGLA | |
| SCHEMBL11880796 | 0.70 | TAAR1 (0.55) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL3823443 | 0.68 | TAAR1 (0.68) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL8072287 | 0.67 | SIGMAR1 (0.58) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL28836465 | 0.65 | KDM4E (0.53) | ALDH1A1KDM4EMAPTGAAGLA | |
| SCHEMBL10464197 | 0.65 | SIGMAR1 (0.56) | SLC6A2SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL4223544 | 0.64 | KDM4E (0.56) | ALDH1A1KDM4EMAPTGAAGLA | |
| SCHEMBL7394097 | 0.64 | TAAR1 (0.54) | CYP2D6SLC6A2TAAR1MAOASLC6A4 |
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-0233413-A2 | 3-(2-Aminoethyl)indole and -indoline derivatives, processes for their preparation and pharmaceutical compositions containing them | SMITHKLINE BEECHAM PHARMA GmbH (DE) | 1987-08-26 | — | — | EP | claimed |