Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.48 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.48 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.48 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
| ▸ | PRSS3 | P35030 | 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 | |
|---|---|---|---|---|
| SCHEMBL28089452 | 0.83 | VCAM1 (0.53) | ALDH1A1 | |
| SCHEMBL14905830 | 0.77 | FKBP1A (0.74) | FKBP1AALDH1A1MAPK1ACHELMNA | |
| SCHEMBL28089580 | 0.76 | TSHR (0.40) | KMT2AMEN1HTT | |
| SCHEMBL28089586 | 0.76 | TSHR (0.40) | KMT2AMEN1HTT | |
| SCHEMBL14895147 | 0.74 | FKBP1A (0.67) | FKBP1AALDH1A1MAPK1ACHELMNA | |
| SCHEMBL9451880 | 0.74 | FKBP1A (0.67) | FKBP1AALDH1A1MAPK1ACHELMNA | |
| SCHEMBL16164040 | 0.74 | FKBP1A (0.67) | FKBP1AALDH1A1MAPK1ACHELMNA | |
| SCHEMBL14895148 | 0.74 | FKBP1A (0.67) | FKBP1AALDH1A1MAPK1ACHELMNA | |
| SCHEMBL695457 | 0.73 | FKBP1A (0.48) | FKBP1AALDH1A1MAPK1LMNAKMT2A | |
| SCHEMBL915382 | 0.73 | KMT2A (0.59) | ALDH1A1LMNAKMT2AMEN1MAPT |
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-103958505-B | For treating dibasic 3,4-diaminourea-3-cyclobutane-1,2-dione compounds of chemokine mediated pathology | 高德美研究及发展公司 | 2016-08-24 | — | — | CN | disclosed |