Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | TRPM5 | Q9NZQ8 | 7/20 | 0.38 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9229362 | 1.00 | HTR2C (0.39) | HTR2CTRPM5ASH1LKDM4EHTR2A | |
| SCHEMBL9231573 | 0.86 | HTR2C (0.55) | HTR2CHTR2ALMNACYP1A2CYP3A4 | |
| Fumaric Acid SCHEMBL8959671 | 0.79 | HTR2C (0.45) | HTR2CTRPM5KDM4EHTR2ALMNA | |
| Fumaric Acid SCHEMBL8959661 | 0.79 | HTR2C (0.45) | HTR2CTRPM5KDM4EHTR2ALMNA | |
| SCHEMBL8959659 | 0.78 | ICMT (0.32) | KDM4EDAO | |
| SCHEMBL8959654 | 0.78 | ICMT (0.32) | KDM4EDAO | |
| SCHEMBL8959995 | 0.77 | TRPM5 (0.44) | HTR2CTRPM5 | |
| SCHEMBL8959761 | 0.76 | TRPM5 (0.39) | HTR2CTRPM5KDM4EHTR2AHPGD | |
| Fumaric Acid SCHEMBL8959756 | 0.70 | TRPM5 (0.47) | TRPM5 | |
| Fumaric Acid SCHEMBL8959767 | 0.70 | TRPM5 (0.47) | TRPM5 |
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-0655440-A2 | 1-Aminoethylindoles | F. HOFFMANN-LA ROCHE AG (CH) | 1995-05-31 | — | — | EP | disclosed |