Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | MAPK10 | P53779 | 11/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.39 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7702043 | 0.82 | NOS3 (0.44) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL28542282 | 0.81 | MAPK10 (0.50) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL7705693 | 0.81 | NOS3 (0.42) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL7697815 | 0.78 | NOS3 (0.41) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL7698312 | 0.77 | NOS3 (0.43) | MAOANOS3NOS2CA1CA2 | |
| SCHEMBL163051 | 0.77 | MAPK10 (0.55) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL29384557 | 0.77 | MAPK10 (0.55) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL28190730 | 0.77 | NOS3 (0.55) | MAOANOS3NOS2MAPK10MAPK9 | |
| SCHEMBL10425795 | 0.75 | MAPK10 (0.69) | MAPK10MAPK9MAPK14MAPK8CA1 | |
| Hydrochloric Acid SCHEMBL27495714 | 0.75 | MAPK10 (0.54) | MAOANOS3NOS2MAPK10MAPK9 |
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-0901488-B1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | BASILEA PHARMACEUTICA AG (CH) | 2002-11-06 | — | — | EP | disclosed |
| EP-0901488-A1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1999-03-17 | — | — | EP | disclosed |
| US-5866583-A | Substituted 2,4-diaminopyrimidines | HOFFMANN-LA ROCHE INC. (US) | 1999-02-02 | — | — | US | disclosed |
| WO-1997043277-A1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-11-20 | — | — | WO | disclosed |