Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.35 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.35 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL3618684 | 0.82 | KDM4E (0.56) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL9414768 | 0.73 | GAA (0.61) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL3375188 | 0.73 | MAPT (0.39) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL30804592 | 0.72 | KDM4E (0.55) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL395135 | 0.72 | KDM4E (0.55) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL30804597 | 0.72 | KDM4E (0.55) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL8930739 | 0.70 | ALDH1A1 (0.40) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL21486442 | 0.70 | KDM4E (0.48) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL28200735 | 0.70 | KDM4E (0.48) | KDM4ETSHRHPGDHSD17B10GAA | |
| SCHEMBL6761348 | 0.67 | ALDH1A1 (0.48) | TSHRHPGDHSD17B10GAAALDH1A1 |
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-0797980-A1 | Oxidation hair dye composition comprising a 2,5-diaminobenzonitrile as well as 2,5-diaminobenzonitrile compounds | Wella Aktiengesellschaft (DE) | 1997-10-01 | — | — | EP | disclosed |