Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 3/20 | 0.47 |
| ▸ | KRAS | P01116 | 2/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.45 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.45 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.43 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | IDH1 | O75874 | 2/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MMP14 | P50281 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28519323 | 0.81 | PTGER4 (0.55) | TRPV1PIK3CALMNAGAAPTGER4 | |
| SCHEMBL28519320 | 0.81 | PTGER4 (0.55) | TRPV1PIK3CALMNAGAAPTGER4 | |
| SCHEMBL30944279 | 0.81 | PTGER4 (0.55) | TRPV1PIK3CALMNAGAAPTGER4 | |
| SCHEMBL9126370 | 0.77 | SOS1 (0.44) | SOS1KRASTRPV1LMNAGAA | |
| SCHEMBL9126558 | 0.77 | SOS1 (0.44) | SOS1KRASTRPV1LMNAGAA | |
| SCHEMBL9128021 | 0.74 | MEN1 (0.54) | GAAAURKB | |
| SCHEMBL29254110 | 0.74 | ALDH1A1 (0.50) | SOS1KRASLMNAGAALTC4S | |
| SCHEMBL15540540 | 0.74 | ALDH1A1 (0.54) | LMNAGAALTC4S | |
| SCHEMBL12871845 | 0.74 | ALDH1A1 (0.54) | LMNAGAALTC4S | |
| SCHEMBL8518963 | 0.72 | LMNA (0.61) | LMNAGAAEPHX2LTC4S |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5440062-A | One-(substituted)amino-7-(substituted)imino-1,3,5-cycloheptatriene-metal complexes as catalysts | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1995-08-08 | — | — | US | disclosed |
| US-5162586-A | Catalyst complex containing copper, a disubstituted aminetroponeimine chelating ligand and an organometallic reagent | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1992-11-10 | — | — | US | disclosed |
| US-4962214-A | COPPER AMINOTROPONEIMINE COMPLEX CATALYSTS | MASSACHUSETTES INSTITUTE OF TECHNOLOGY (US) | 1990-10-09 | — | — | US | disclosed |
| WO-1989010916-A1 | ENANTIOSELECTIVE ADDITION OF HYDROCARBONS TO ALPHA,BETA-UNSATURATED CARBONYL COMPOUNDS | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 1989-11-16 | — | — | WO | disclosed |