Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 4/20 | 0.50 |
| ▸ | MAOB | P27338 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL18025680 | 0.78 | ENPP2 (0.47) | TDP1 | |
| SCHEMBL17934442 | 0.77 | ENPP2 (0.54) | ALDH1A1 | |
| SCHEMBL13418181 | 0.77 | TP53 (0.42) | ALOX15ALDH1A1HPGDALOX12HSD17B10 | |
| Hydrogen Peroxide SCHEMBL10839871 | 0.74 | TDP1 (0.71) | MAOAMAOBTDP1KCNH2ALOX15 | |
| Hydrogen Peroxide SCHEMBL10839772 | 0.74 | TDP1 (0.71) | MAOAMAOBTDP1KCNH2ALOX15 | |
| SCHEMBL6426700 | 0.72 | ERN1 (0.41) | MAOBFFAR1CYP4F2CYP4A11 | |
| SCHEMBL14528932 | 0.72 | CYP4F2 (0.63) | MAOAMAOBFFAR1CYP4F2CYP4A11 | |
| SCHEMBL9454318 | 0.71 | TSHR (0.59) | MAOAMAOBTDP1OPRK1KCNH2 | |
| 3-Phenethylphenol SCHEMBL717571 | 0.71 | OPRK1 (0.74) | OPRK1OPRM1OPRD1NR1H3 | |
| SCHEMBL10263396 | 0.71 | MGLL (0.45) | MAOAALOX15ALDH1A1HPGDALOX12 |
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-3786156-A1 | 10H-PHENOTHIAZINE FERROPTOSIS INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | Chengdu Henghao Investment Co. Limited (CN) | 2021-03-03 | — | — | EP | disclosed |