Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.59 |
| ▸ | NAAA | Q02083 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18248625 | 1.00 | HRH1 (0.64) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA | |
| SCHEMBL7376400 | 0.98 | SMN1; SMN2 (0.61) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA | |
| SCHEMBL9774 | 0.93 | SMN1; SMN2 (0.68) | HRH1SMN1; SMN2CYP1A2CYP2C19PARP10 | |
| Hydrochloric Acid SCHEMBL3513717 | 0.91 | SMN1; SMN2 (0.66) | HRH1SMN1; SMN2CYP1A2CYP2C19PARP10 | |
| SCHEMBL18248489 | 0.91 | HRH1 (0.54) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA | |
| SCHEMBL18248642 | 0.91 | HRH1 (0.54) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA | |
| SCHEMBL18248609 | 0.89 | HRH1 (0.51) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA | |
| SCHEMBL9658041 | 0.88 | SMN1; SMN2 (0.61) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA | |
| SCHEMBL626826 | 0.87 | HRH1 (0.57) | HRH1SMN1; SMN2CYP1A2CYP2C19PARP10 | |
| SCHEMBL2960008 | 0.86 | SMN1; SMN2 (0.64) | HRH1SMN1; SMN2CYP1A2CYP2C19NAAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5030642-A | Antitumor agents | G. D. SEARLE & CO. (US) | 1991-07-09 | — | — | US | disclosed |
| EP-0310015-A2 | Renin-inhibiting dipeptides, process for their preparation, medicines containing them and their use | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-04-05 | — | — | EP | disclosed |