Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.41 |
| ▸ | CCR5 | P51681 | 1/20 | 0.41 |
| ▸ | CCR8 | P51685 | 1/20 | 0.41 |
| ▸ | F7 | P08709 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | F3 | P13726 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 4/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7702917 | 0.83 | NPY5R (0.51) | CYP1A2CCR1CCR5CCR8PARP1 | |
| SCHEMBL7701012 | 0.82 | NOS3 (0.49) | CYP1A2CCR1CCR5CCR8ALDH1A1 | |
| SCHEMBL7702378 | 0.80 | NPY5R (0.54) | MAPK10CHRM1ALDH1A1NPC1RAB9A | |
| SCHEMBL7705661 | 0.79 | NOS3 (0.44) | CCR1CCR5CCR8MAPK10ALDH1A1 | |
| SCHEMBL28340992 | 0.79 | MAPK10 (0.58) | MAPK10CHRM1ALDH1A1PKMHPGD | |
| SCHEMBL30920956 | 0.77 | CYP2A6 (0.40) | CYP1A2CCR1CCR5CCR8ALDH1A1 | |
| SCHEMBL11088492 | 0.75 | CYP1A2 (0.49) | CYP1A2ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL7698058 | 0.74 | NOS3 (0.44) | CYP1A2MAPK10ALDH1A1MAPTKDM4E | |
| SCHEMBL27601351 | 0.73 | MAPK10 (0.52) | MAPK10CHRM1ALDH1A1PKMNPSR1 | |
| SCHEMBL27470592 | 0.73 | CYP1A2 (0.45) | CYP1A2CCR1CCR5CCR8CHRM1 |
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 |