Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KDR | P35968 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9045199 | 0.86 | MAPK14 (0.37) | MAPK14ALDH1A1KDRCYP3A4CYP2C19 | |
| SCHEMBL9045658 | 0.85 | ATIC (0.36) | MAPK14ALDH1A1MAPK1KDR | |
| SCHEMBL9044092 | 0.83 | MAPK14 (0.32) | MAPK14ALDH1A1MAPK1KDR | |
| SCHEMBL9045359 | 0.78 | MAPK14 (0.36) | MAPK14ALDH1A1KDR | |
| SCHEMBL9044079 | 0.78 | MAPK14 (0.36) | MAPK14ALDH1A1KDR | |
| SCHEMBL9483012 | 0.77 | L3MBTL1 (0.40) | ALDH1A1 | |
| SCHEMBL9340437 | 0.77 | L3MBTL1 (0.40) | ALDH1A1 | |
| SCHEMBL9045922 | 0.76 | TAS1R3 (0.35) | MAPK14ALDH1A1 | |
| SCHEMBL9047678 | 0.75 | MAPK14 (0.34) | MAPK14ALDH1A1MAPK1KDR | |
| SCHEMBL9047978 | 0.75 | KMT2A (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0432677-B1 | N-(pyrrolo[2,3-d]pyrimidin-3-ylacyl)-glutamic acid derivatives | UNIV PRINCETON (US) | 1996-03-06 | — | — | EP | disclosed |
| US-5344932-A | N-(pyrrolo(2,3-d)pyrimidin-3-ylacyl)-glutamic acid derivatives | TRUSTEES OF PRINCETON UNIVERSITY (US) | 1994-09-06 | — | — | US | disclosed |
| US-5248775-A | Pyrrolo(2,3-d)pyrimidines | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1993-09-28 | — | — | US | disclosed |
| EP-0432677-A1 | N-(pyrrolo[2,3-d]pyrimidin-3-ylacyl)-glutamic acid derivatives | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 1991-06-19 | — | — | EP | disclosed |