Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 2/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | GRIA1 | P42261 | 2/20 | 0.36 |
| ▸ | CACNG8 | Q8WXS5 | 2/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 7/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 6/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 6/20 | 0.35 |
| ▸ | GSK3A | P49840 | 6/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | BCL6 | P41182 | 1/20 | 0.35 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.34 |
| ▸ | CDK1 | P06493 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7821491 | 0.84 | CYP1A2 (0.40) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL7832374 | 0.80 | PDE3B (0.37) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL7832613 | 0.78 | CDC7 (0.53) | PDE3BPDE3ACYP1A2AHR | |
| SCHEMBL7831069 | 0.76 | RAB9A (0.35) | CYP1A2CYP11B1CYP11B2KDRLCK | |
| SCHEMBL7822353 | 0.75 | BCL6 (0.57) | CYP1A2CYP11B1CYP11B2KDRGSK3B | |
| SCHEMBL7830469 | 0.75 | CYP1A2 (0.42) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL7833358 | 0.75 | EIF2AK2 (0.43) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL8477066 | 0.74 | BCL6 (0.56) | CYP1A2CYP11B1CYP11B2KDRGSK3B | |
| SCHEMBL7829575 | 0.73 | MAOB (0.47) | PDE3BPDE3ACYP1A2CYP11B1CYP11B2 | |
| SCHEMBL7830473 | 0.73 | PTK2 (0.44) | CYP1A2CYP11B1CYP11B2GLO1KDR |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0802914-B1 | ARYL- AND HETEROARYL- PURINE AND PYRIDOPYRIMIDINE DERIVATIVES | PHARMACIA & UPJOHN SPA (IT) | 2001-06-06 | — | — | EP | claimed |
| EP-0802914-A1 | ARYL AND HETEROARYL PURINE COMPOUNDS | PHARMACIA & UPJOHN S.p.A. (IT) | 1997-10-29 | — | — | EP | claimed |
| WO-1997018212-A1 | ARYL AND HETEROARYL PURINE COMPOUNDS | PHARMACIA & UPJOHN S.P.A. (IT) | 1997-05-22 | — | — | WO | claimed |
| EP-0802914-B1 | ARYL- AND HETEROARYL- PURINE AND PYRIDOPYRIMIDINE DERIVATIVES | PHARMACIA & UPJOHN SPA (IT) | 2001-06-06 | — | — | EP | disclosed |
| US-5965563-A | NOVEL PURINE DERIVATIVES SUCH AS N6-(2-OXINDOL-5-YL) ADENINE, METHODS OF SYNTHESIZING THEM; USE AS TYROSINE KINASE INHIBITORS | PHARMACIA & UPJOHN S.P.A. (IT) | 1999-10-12 | — | — | US | disclosed |
| EP-0802914-A1 | ARYL AND HETEROARYL PURINE COMPOUNDS | PHARMACIA & UPJOHN S.p.A. (IT) | 1997-10-29 | — | — | EP | disclosed |
| WO-1997018212-A1 | ARYL AND HETEROARYL PURINE COMPOUNDS | PHARMACIA & UPJOHN S.P.A. (IT) | 1997-05-22 | — | — | WO | disclosed |