Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | ACP1 | P24666 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TACR3 | P29371 | 6/20 | 0.47 |
| ▸ | TACR2 | P21452 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10673862 | 0.99 | CYP2C9 (0.59) | CYP2C9ALDH1A1ACP1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL10676746 | 0.87 | CYP2C9 (0.69) | CYP2C9ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL10672389 | 0.84 | CYP2C9 (0.75) | CYP2C9ALDH1A1ACP1KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL10677070 | 0.80 | KDM4E (0.51) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL10674770 | 0.80 | CYP2C9 (0.57) | CYP2C9ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL10675093 | 0.79 | CYP2C9 (0.71) | CYP2C9ALDH1A1ACP1KDM4ETACR3 | |
| SCHEMBL10683013 | 0.79 | ALDH1A1 (0.53) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL10677865 | 0.78 | KDM4E (0.54) | CYP2C9ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL10679146 | 0.78 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDMAPTNPSR1 | |
| SCHEMBL10674105 | 0.77 | HPGD (0.51) | ALDH1A1ACP1KDM4EHPGDMAPT |
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-4788204-A | TRANQUILIZERS; ANTICONVULSANTS; ANGINA AND IMMUNODIFICIENCY TREATMENTS | RHONE-POULENC SANTE (FR) | 1988-11-29 | — | — | US | disclosed |
| US-4788199-A | ANXIOLYTICS, ANTICONVULSANTS, ANTIANGINA AGENTS | RHONE-POULENC SANTE (FR) | 1988-11-29 | — | — | US | disclosed |