Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.37 |
| ▸ | MAOA | P21397 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1387826 | 0.84 | GAA (0.36) | MAPTLMNACYP19A1 | |
| SCHEMBL6552435 | 0.78 | ALDH1A1 (0.34) | ALDH1A1OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL6552319 | 0.74 | KIF11 (0.45) | OPRM1OPRD1OPRK1OPRL1MAPT | |
| SCHEMBL28055881 | 0.74 | ALDH1A1 (0.32) | ALDH1A1CYP2A6MAPT | |
| Benzonitrile SCHEMBL3474680 | 0.67 | TSHR (0.88) | TSHRMAOBMAOAALDH1A1CYP2A6 | |
| Ammonia Solution, Strong SCHEMBL5497679 | 0.67 | — | — | |
| SCHEMBL18682202 | 0.66 | TSHR (0.46) | TSHRMAOBMAOAALDH1A1CYP2A6 | |
| SCHEMBL18362650 | 0.66 | LMNA (0.50) | TSHRMAOBMAOAALDH1A1CYP2A6 | |
| SCHEMBL29390519 | 0.65 | MAPT (0.36) | ALDH1A1OPRK1MAPTLMNAPDK2 | |
| SCHEMBL23046650 | 0.65 | TSHR (0.93) | TSHRMAOBMAOAALDH1A1CYP2A6 |
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-1047411-B1 | SUBSTITUTED DIPHENYL INDANONE, INDANE AND INDOLE COMPOUNDS AND ANALOGUES THEREOF USEFUL FOR THE TREATMENT OR PREVENTION OF DISEASES CHARACTERIZED BY ABNORMAL CELL PROLIFERATION | HARVARD COLLEGE (US) | 2004-02-11 | — | — | EP | disclosed |