Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 9/20 | 0.42 |
| ▸ | PIK3R2 | O00459 | 9/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 9/20 | 0.42 |
| ▸ | PIK3CB | P42338 | 9/20 | 0.42 |
| ▸ | PIK3CG | P48736 | 9/20 | 0.42 |
| ▸ | PIK3R5 | Q8WYR1 | 9/20 | 0.42 |
| ▸ | PIK3R3 | Q92569 | 9/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | ALPL | P05186 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9832871 | 0.90 | PTGS1 (0.49) | PTGS1PTGS2MAPTPOLBCCNA2 | |
| SCHEMBL9833914 | 0.82 | PTGS1 (0.44) | PTGS1PTGS2MAPTPOLBCCNA2 | |
| SCHEMBL8588667 | 0.81 | CCNA2 (0.49) | PTGS1PTGS2CCNA2CDK2CCNA1 | |
| SCHEMBL9166215 | 0.81 | CCNA2 (0.44) | PTGS1PTGS2CCNA2CDK2CCNA1 | |
| SCHEMBL9831849 | 0.80 | PTGS1 (0.42) | PTGS1PTGS2MAPTPOLBCCNA2 | |
| SCHEMBL5256651 | 0.78 | PTGS2 (0.68) | PTGS1PTGS2CCNA2CDK2CCNA1 | |
| SCHEMBL9833649 | 0.77 | PTGS1 (0.46) | PTGS1PTGS2MAPTPOLBCCNA2 | |
| SCHEMBL5253371 | 0.76 | PTGS1 (0.68) | PTGS1PTGS2CCNA2CDK2CCNA1 | |
| SCHEMBL10569407 | 0.76 | MAPT (0.42) | PTGS1PTGS2MAPTPOLBCCNA2 | |
| SCHEMBL14502642 | 0.75 | CCNA2 (0.53) | PTGS1PTGS2CCNA2CDK2CCNA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0274443-B1 | HETEROARYL 3-OXO-PROPANENITRILE DERIVATIVES AND PROCESS FOR THEIR PREPARATION | FARMITALIA CARLO ERBA S.r.l. (IT) | 1991-05-29 | — | — | EP | disclosed |
| US-4816467-A | BACTERICIDES, VIRICIDES | FARMITALIA CARLO ERBA S.R.L (IT) | 1989-03-28 | — | — | US | disclosed |
| EP-0274443-A1 | Heteroaryl 3-oxo-propanenitrile derivatives and process for their preparation | FARMITALIA CARLO ERBA S.r.l. (IT) | 1988-07-13 | — | — | EP | disclosed |