Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AXL | P30530 | 3/20 | 0.47 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.47 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.46 |
| ▸ | CDK8 | P49336 | 4/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.41 |
| ▸ | EGFR | P00533 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | CCNC | P24863 | 1/20 | 0.37 |
| ▸ | CDK7 | P50613 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | CCNH | P51946 | 1/20 | 0.37 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2078432 | 0.98 | AXL (0.48) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| SCHEMBL64925 | 0.98 | — | — | |
| SCHEMBL29407705 | 0.98 | — | — | |
| Hydrochloric Acid SCHEMBL31308615 | 0.96 | AXL (0.47) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| Hydrochloric Acid SCHEMBL311520 | 0.96 | AXL (0.47) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| Hydrochloric Acid SCHEMBL310786 | 0.96 | AXL (0.47) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| SCHEMBL3845938 | 0.96 | AXL (0.47) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| SCHEMBL15880172 | 0.90 | AXL (0.42) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| Methylene Chloride SCHEMBL27892265 | 0.90 | AXL (0.42) | AXLNUDT1PIK3CAPIK3CDPIK3CB | |
| Urea SCHEMBL15380856 | 0.88 | RIPK1 (0.49) | AXLNUDT1PIK3CAPIK3CDPIK3CB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1212325-A2 | A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR | ELI LILLY AND COMPANY (US) | 2002-06-12 | — | — | EP | disclosed |
| WO-2001014379-A2 | A NOVEL CRYSTALLINE FORM OF DISODIUM N-[4-[2-(2-AMINO-4,7-DIHYDRO-4-OXO-3H-PYRROLO[2,3-D]-PYRIMIDIN-5-YL)ETHYL]BENZOYL]-L-GLUTAMIC ACID SALT AND PROCESSES THEREFOR | ELI LILLY AND COMPANY (US) | 2001-03-01 | — | — | WO | disclosed |