Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.61 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.60 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.60 |
| ▸ | HTR2A | P28223 | 2/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 2/20 | 0.59 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | MC4R | P32245 | 1/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL3868656 | 0.90 | NPC1 (0.67) | SMN1; SMN2NPC1RAB9AKDM4E | |
| SCHEMBL3870972 | 0.87 | MCHR1 (0.80) | HDAC6SMN1; SMN2MCHR1CHRM1HTR2A | |
| SCHEMBL3869045 | 0.86 | MCHR1 (0.81) | HDAC6MCHR1CHRM1HTR2ACYP2D6 | |
| SCHEMBL14456882 | 0.85 | MCHR1 (0.60) | HDAC6SMN1; SMN2HDAC4KCNH2HDAC1 | |
| SCHEMBL6250979 | 0.85 | MCHR1 (0.70) | HDAC6SMN1; SMN2HDAC4KCNH2HDAC1 | |
| SCHEMBL7705653 | 0.85 | ALDH1A1 (0.77) | SMN1; SMN2MCHR1CHRM1HTR2ACYP2D6 | |
| SCHEMBL5947786 | 0.84 | HDAC6 (0.60) | HDAC6HDAC4KCNH2HDAC1NPC1 | |
| SCHEMBL6250405 | 0.84 | MCHR1 (0.73) | HDAC6SMN1; SMN2HDAC4KCNH2HDAC1 | |
| SCHEMBL5650376 | 0.84 | SMN1; SMN2 (0.54) | HDAC6SMN1; SMN2MCHR1CHRM1HTR2A | |
| SCHEMBL3868266 | 0.82 | MCHR1 (0.82) | HDAC6SMN1; SMN2HDAC1MCHR1CHRM1 |
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 |