Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 3/20 | 0.43 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 4/20 | 0.36 |
| ▸ | NOS1 | P29475 | 4/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL902861 | 0.77 | NOS1 (0.53) | ASIC3KDM4ELMNAALDH1A1NOS3 | |
| SCHEMBL27508570 | 0.75 | ASIC3 (0.46) | ASIC3NOS3NOS1 | |
| SCHEMBL901874 | 0.75 | ASIC3 (0.47) | ASIC3KDM4ELMNANOS3NOS1 | |
| SCHEMBL4598193 | 0.73 | MTNR1A (0.46) | MTNR1AKDM4EALDH1A1HPGDMTNR1B | |
| SCHEMBL1567114 | 0.70 | MTNR1A (0.73) | MTNR1AMTNR1B | |
| SCHEMBL6921461 | 0.70 | CYP1A2 (0.49) | MTNR1AKDM4ELMNAMTNR1B | |
| SCHEMBL20773417 | 0.69 | KCNH2 (0.53) | ALDH1A1HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL5309632 | 0.68 | MPO (0.56) | KDM4E | |
| SCHEMBL10348018 | 0.68 | ALDH1A1 (0.54) | MTNR1ALMNAALDH1A1HPGDMTNR1B | |
| SCHEMBL19212244 | 0.68 | PTGDR2 (0.47) | MTNR1AHPGDMTNR1BHDAC3HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012041476-A1 | PYRIDINE AND ISOQUINOLINE DERIVATIVES AS SYK- AND JAK-KINASE INHIBITORS | ALMIRALL, S.A. (ES) | 2012-04-05 | — | — | WO | disclosed |