Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 1/20 | 0.50 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.50 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | CCNT1 | O60563 | 7/20 | 0.48 |
| ▸ | CDK9 | P50750 | 5/20 | 0.48 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.46 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.46 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.45 |
| ▸ | NOS1 | P29475 | 1/20 | 0.45 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.45 |
| ▸ | CLK1 | P49759 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | HTR6 | P50406 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4646979 | 0.83 | KDM4E (0.47) | HPGDCCNT1CDK9NTRK1NTRK3 | |
| SCHEMBL27893661 | 0.83 | GRIN2D (0.49) | — | |
| SCHEMBL6756755 | 0.82 | GHSR (0.46) | MAOBHTR6AURKAABL1 | |
| SCHEMBL6229701 | 0.79 | HPGD (0.65) | HPGDFFAR1NOS1MAOB | |
| SCHEMBL6696141 | 0.79 | HPGD (0.60) | KDM5AKDM4CKDM5BHPGDFFAR1 | |
| SCHEMBL6692696 | 0.77 | FFAR1 (0.67) | KDM5AKDM4CKDM5BHPGDFFAR1 | |
| SCHEMBL12466322 | 0.77 | DYRK1A (0.46) | KDM5AKDM4CKDM5BHPGDCCNT1 | |
| SCHEMBL6754268 | 0.77 | MAPT (0.56) | — | |
| SCHEMBL12466337 | 0.77 | CCNT1 (0.57) | KDM5AKDM4CKDM5BCCNT1DYRK1A | |
| SCHEMBL15378645 | 0.75 | CLK4 (0.46) | KDM5AKDM4CKDM5BCCNT1NTRK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012101065-A2 | PYRIMIDINE BIARYL AMINE COMPOUNDS AND THEIR USES | NOVARTIS AG (CH) | 2012-08-02 | — | — | WO | disclosed |
| WO-2012101066-A1 | PYRIDINE BIARYL AMINE COMPOUNDS AND THEIR USES | NOVARTIS AG (CH) | 2012-08-02 | — | — | WO | disclosed |