Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 3/20 | 0.57 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | MDH2 | P40926 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.55 |
| ▸ | LTA4H | P09960 | 4/20 | 0.54 |
| ▸ | PLA2G2A | P14555 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.54 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | KIF20A | O95235 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11602121 | 0.87 | ALDH1A1 (0.61) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL6098744 | 0.85 | ALDH1A1 (0.57) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL11194622 | 0.85 | ALDH1A1 (0.59) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL6764594 | 0.84 | MAOB (0.61) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL11620503 | 0.83 | TRPM8 (0.61) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL28123392 | 0.82 | TRPM8 (0.60) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL8551129 | 0.82 | HTT (0.63) | HTR1DALDH1A1MEN1KMT2AKDM4E | |
| SCHEMBL9023222 | 0.82 | NR4A2 (0.66) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL18549394 | 0.82 | LTA4H (0.63) | HTR1DTRPM8ALDH1A1HPGDMDH2 | |
| SCHEMBL5114492 | 0.81 | POLB (0.59) | HTR1DTRPM8ALDH1A1HPGDMDH2 |
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-6187805-B1 | TREATING CONDITION FOR WHICH SELECTIVE AGONISM OR ANTAGONISM OF 5-HT-6 RECEPTORS IS INDICATED BY ADMINISTERING COMPOUNDS SUCH AS N,N-DIMETHYL 2-(1-(BENZENESULPHONYL)-5-METHOXY-1H-INDOL-3-YL)ETHYLAMINE | MERCK SHARP & DOHME LTD. (GB) | 2001-02-13 | — | — | US | disclosed |