Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | NNMT | P40261 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | USP7 | Q93009 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4119372 | 0.76 | CYP1A2 (0.36) | SIRT2SIRT1NNMTPDE10ACYP1A2 | |
| SCHEMBL2266765 | 0.74 | CASP3 (0.44) | KDM4EALDH1A1RAB9AMAPTHPGD | |
| SCHEMBL2267089 | 0.72 | HTR2A (0.43) | SIRT2SIRT1NNMTHTR2AHTR2C | |
| SCHEMBL5752945 | 0.72 | ALDH1A1 (0.45) | KDM4EGAAALDH1A1RAB9AMAPT | |
| Hydrochloric Acid SCHEMBL6261576 | 0.72 | CASP3 (0.43) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL8569551 | 0.72 | TXNRD1 (0.50) | JAK2RAB9AMAPT | |
| SCHEMBL8570449 | 0.72 | POLB (0.41) | KDM4EGAASIRT2ALDH1A1NPC1 | |
| SCHEMBL5751466 | 0.71 | HRH4 (0.51) | KDM4EGAAALDH1A1MAPTHPGD | |
| SCHEMBL2270412 | 0.70 | GAA (0.47) | KDM4EGAAALDH1A1MAPTHPGD | |
| SCHEMBL2267531 | 0.70 | CHRNB2 (0.47) | KDM4EALDH1A1MAPTHPGDPOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0623620-B1 | 5-HT3 Pyrrolopyrazine derivatives | ADIR (FR) | 1998-09-09 | — | — | EP | disclosed |
| US-5599812-A | ANTISEROTONINE AGENTS | ADIR ET COMPAGNIE (FR) | 1997-02-04 | — | — | US | disclosed |
| EP-0623620-A1 | 5-HT3 Pyrrolopyrazine derivatives | ADIR ET COMPAGNIE (FR) | 1994-11-09 | — | — | EP | disclosed |