Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.37 |
| ▸ | GART | P22102 | 4/20 | 0.36 |
| ▸ | DHFR | P00374 | 5/20 | 0.36 |
| ▸ | ATIC | P31939 | 1/20 | 0.36 |
| ▸ | SHMT1 | P34896 | 1/20 | 0.36 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.36 |
| ▸ | TYMS | P04818 | 2/20 | 0.36 |
| ▸ | FOLR2 | P14207 | 1/20 | 0.36 |
| ▸ | FOLR1 | P15328 | 1/20 | 0.36 |
| ▸ | SLC19A1 | P41440 | 1/20 | 0.36 |
| ▸ | SLC46A1 | Q96NT5 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL9841754 | 0.88 | FOLR1 (0.36) | CA2CA1KDM4EHPGDFOLH1 | |
| SCHEMBL9047678 | 0.87 | MAPK14 (0.34) | CA2CA1KDM4EHPGDCA12 | |
| SCHEMBL9777804 | 0.84 | ADORA1 (0.34) | CA2CA1KDM4EHPGDFOLH1 | |
| SCHEMBL9043718 | 0.82 | ATIC (0.43) | GARTDHFRATICSHMT1SHMT2 | |
| SCHEMBL9046114 | 0.81 | ADORA1 (0.46) | — | |
| SCHEMBL9049344 | 0.81 | CA2 (0.43) | CA2CA1KDM4EHPGDFOLH1 | |
| SCHEMBL9045445 | 0.80 | ADORA1 (0.38) | KDM4E | |
| SCHEMBL9044285 | 0.80 | NPC1 (0.38) | CA2CA1KDM4EHPGDCA12 | |
| SCHEMBL9046822 | 0.80 | ADORA1 (0.38) | — | |
| SCHEMBL9046427 | 0.80 | ADORA1 (0.38) | — |
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 |