Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CHKA | P35790 | 1/20 | 0.34 |
| ▸ | USP19 | O94966 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.33 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.32 |
| ▸ | PAK4 | O96013 | 4/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | KHK | P50053 | 1/20 | 0.31 |
| ▸ | TACR1 | P25103 | 2/20 | 0.31 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.31 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27921094 | 1.00 | DPP4 (0.41) | DPP4PLD1CA2CHKAUSP19 | |
| Hydrochloric Acid SCHEMBL28060473 | 0.98 | DPP4 (0.40) | DPP4PLD1CA2CHKAUSP19 | |
| SCHEMBL26131474 | 0.87 | CA2 (0.50) | DPP4PLD1CA2CHKAUSP19 | |
| SCHEMBL12501436 | 0.87 | CA2 (0.50) | DPP4PLD1CA2CHKAUSP19 | |
| SCHEMBL26128923 | 0.87 | CA2 (0.50) | DPP4PLD1CA2CHKAUSP19 | |
| SCHEMBL2321580 | 0.85 | DPP4 (0.40) | DPP4PLD1CA2CHRNB2CHRNA3 | |
| SCHEMBL1710523 | 0.85 | DPP4 (0.40) | DPP4PLD1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL747476 | 0.85 | DPP4 (0.40) | DPP4PLD1CA2CHRNB2CHRNA3 | |
| SCHEMBL2415913 | 0.85 | DPP4 (0.40) | DPP4PLD1CHRNB2CHRNA3CHRNA4 | |
| SCHEMBL1502941 | 0.85 | DPP4 (0.40) | DPP4PLD1CHRNB2CHRNA3CHRNA4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110382498-A | Fused imidazole-piperidine JAK inhibitors | 施万生物制药研发IP有限责任公司 | 2019-10-25 | — | — | CN | disclosed |