Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HEXA | P06865 | 3/20 | 0.49 |
| ▸ | HEXB | P07686 | 3/20 | 0.49 |
| ▸ | DHFR | P00374 | 8/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1091936 | 0.83 | DHFR (0.47) | HEXAHEXBDHFRKDM4ENOS2 | |
| SCHEMBL17545030 | 0.82 | DHFR (0.54) | HEXAHEXBDHFRKDM4E | |
| SCHEMBL18681776 | 0.77 | HEXA (0.47) | HEXAHEXBDHFRMAPK1RECQL | |
| SCHEMBL2072604 | 0.77 | HEXA (0.46) | HEXAHEXBDHFRMAPK1RECQL | |
| SCHEMBL4375162 | 0.76 | DHFR (0.49) | HEXAHEXBDHFR | |
| SCHEMBL1091993 | 0.75 | KMT2A (0.36) | HEXAHEXBDHFRPOLB | |
| SCHEMBL1089764 | 0.74 | CDK1 (0.37) | HEXAHEXBDHFRNOS2 | |
| SCHEMBL1090279 | 0.74 | ALDH1A1 (0.39) | HEXAHEXBDHFR | |
| SCHEMBL29262764 | 0.73 | CYP2D6 (0.52) | DHFRNOS2 | |
| SCHEMBL12484463 | 0.73 | HEXA (0.48) | HEXAHEXBDHFR |
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 |
|---|---|---|---|---|---|---|---|
| CN-1134431-C | 2,4-diaminopyrimidine derivatives as dopamine D4 receptor antagonists | ��˹��ŵ�� | 2004-01-14 | — | — | CN | disclosed |
| CN-1218466-A | 2,4-diaminopyrimidine derivatives as dopamine d4 receptor antagonists | JANSSEN PHARMACEUTICA NV (BE) | 1999-06-02 | — | — | CN | disclosed |