Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.45 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.45 |
| ▸ | BACE1 | P56817 | 1/20 | 0.43 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
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) | MAPT | |
| SCHEMBL6552435 | 0.78 | ALDH1A1 (0.34) | OPRM1OPRL1MAPK1OPRD1OPRK1 | |
| SCHEMBL13096618 | 0.75 | KIF11 (0.48) | KIF11OPRM1OPRL1CA4LTA4H | |
| SCHEMBL6551692 | 0.74 | TSHR (0.41) | OPRM1OPRL1BACE1MAPTCA12 | |
| SCHEMBL28839915 | 0.74 | KIF11 (0.48) | KIF11OPRM1OPRL1BACE1BACE2 | |
| SCHEMBL29228547 | 0.70 | OPRM1 (0.47) | OPRM1OPRL1BACE1BACE2CA4 | |
| SCHEMBL20414407 | 0.69 | KMT2A (0.53) | OPRM1OPRL1CA4LTA4HATM | |
| SCHEMBL11545311 | 0.67 | LMNA (0.33) | KIF11OPRM1OPRL1SIRT2ACHE | |
| Ammonia Solution, Strong SCHEMBL5497679 | 0.67 | — | — | |
| SCHEMBL31276971 | 0.66 | ATM (0.53) | OPRM1OPRL1CA4LTA4HATM |
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 |