Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPBWR1 | P48145 | 1/20 | 0.42 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | EDNRA | P25101 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12261572 | 0.79 | NPBWR1 (0.42) | NPBWR1MCHR1KMT2AMEN1GAA | |
| SCHEMBL20320324 | 0.75 | NPBWR1 (0.42) | NPBWR1MCHR1KMT2AMEN1GAA | |
| SCHEMBL4414443 | 0.71 | MTOR (0.52) | TSHRLMNAMTORRAB9AGRM7 | |
| Hydrochloric Acid SCHEMBL10786964 | 0.69 | CYP3A4 (0.54) | ALDH1A1TSHRLMNAMTORRAB9A | |
| SCHEMBL9980569 | 0.69 | LMNA (0.59) | KMT2AMEN1ALDH1A1TSHRSMN1; SMN2 | |
| SCHEMBL15241812 | 0.65 | — | — | |
| Acetic Acid SCHEMBL18138499 | 0.65 | LMNA (0.50) | KMT2AGAAALDH1A1KDM4ETSHR | |
| SCHEMBL21023370 | 0.64 | — | — | |
| SCHEMBL2123340 | 0.64 | — | — | |
| Mebanazine SCHEMBL417872 | 0.63 | AOC3 (0.52) | KMT2AMEN1GAAALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-1818325-A2 | 3,4-DI-substituted cyclobutene-1,2-diones as CXC-chemokine receptor ligands | SCHERING CORPORATION (US) | 2007-08-15 | — | — | EP | disclosed |