Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 10/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 9/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | THPO | P40225 | 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 | |
|---|---|---|---|---|
| SCHEMBL6641612 | 1.00 | HTR6 (0.48) | HTR6HTR2CMTNR1AMTNR1BKDM4E | |
| SCHEMBL6644440 | 0.82 | HTR2C (0.39) | HTR6HTR2CKMT2AMAPK1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL6645380 | 0.81 | HTR2C (0.40) | HTR6HTR2CMTNR1AMTNR1BKDM4E | |
| SCHEMBL905707 | 0.81 | HTR2C (0.38) | HTR2CMAPK1GAA | |
| Hydrochloric Acid SCHEMBL6647522 | 0.78 | HTR6 (0.44) | HTR6HTR2CMTNR1AMTNR1BKDM4E | |
| Fumaric Acid SCHEMBL6647493 | 0.77 | HTR2C (0.45) | HTR6HTR2CMTNR1AMTNR1BKDM4E | |
| Hydrochloric Acid SCHEMBL6647343 | 0.77 | HTR6 (0.44) | HTR6HTR2CMTNR1AMTNR1BKDM4E | |
| Fumaric Acid SCHEMBL6647488 | 0.77 | HTR2C (0.45) | HTR6HTR2CMTNR1AMTNR1BKDM4E | |
| SCHEMBL6646432 | 0.77 | HTR2C (0.33) | HTR2C | |
| Hydrochloric Acid SCHEMBL6643625 | 0.77 | HTR6 (0.45) | HTR6HTR2CMTNR1AMTNR1B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1109813-B1 | PYRROLOINDOLES, PYRIDOINDOLES AND AZEPINOINDOLES AS 5-HT2C AGONISTS | VERNALIS RES LTD (GB) | 2004-08-11 | — | — | EP | claimed |
| US-6433175-B1 | ANTISEROTONINE AGENTS | VERNALIS RESEARCH LIMITED (GB) | 2002-08-13 | — | — | US | claimed |
| EP-1109813-B1 | PYRROLOINDOLES, PYRIDOINDOLES AND AZEPINOINDOLES AS 5-HT2C AGONISTS | VERNALIS RES LTD (GB) | 2004-08-11 | — | — | EP | disclosed |
| US-6433175-B1 | ANTISEROTONINE AGENTS | VERNALIS RESEARCH LIMITED (GB) | 2002-08-13 | — | — | US | disclosed |