Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.49 |
| ▸ | DRD4 | P21917 | 4/20 | 0.49 |
| ▸ | DRD3 | P35462 | 4/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 5/20 | 0.47 |
| ▸ | ABCC1 | P33527 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.46 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HRH1 | P35367 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2766091 | 0.96 | DRD2 (0.52) | DRD2DRD4DRD3ABCB1ABCC1 | |
| SCHEMBL3071421 | 0.79 | ABCB1 (0.55) | DRD2DRD4DRD3ABCB1ABCC1 | |
| SCHEMBL2764253 | 0.77 | KDM4E (0.50) | KDM4EPOLBALDH1A1HPGDL3MBTL1 | |
| SCHEMBL2764515 | 0.77 | KDM4E (0.50) | KDM4EPOLBALDH1A1HPGDL3MBTL1 | |
| SCHEMBL2767252 | 0.77 | KDM4E (0.49) | KDM4EHRH3HTR2ATP53POLB | |
| SCHEMBL2765186 | 0.76 | HTR7 (0.57) | DRD2DRD4DRD3ABCB1ABCC1 | |
| SCHEMBL38657307 | 0.75 | ABCB1 (0.53) | DRD2DRD4DRD3ABCB1ABCC1 | |
| SCHEMBL12962320 | 0.75 | DRD2 (0.61) | DRD2DRD4DRD3HTR2AHRH1 | |
| SCHEMBL3087050 | 0.74 | HRH3 (0.57) | DRD2DRD4DRD3ABCB1ABCC1 | |
| SCHEMBL5682153 | 0.74 | TP53 (0.49) | KDM4EHRH3HTR2ATP53POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1400515-B1 | CYCLIC DIAMINE COMPOUND HAVING FIVE-MEMBERED CYCLIC GROUP | KOWA CO (JP) | 2010-04-14 | — | — | EP | disclosed |
| EP-1400515-A1 | CYCLIC DIAMINE COMPOUND HAVING FIVE-MEMBERED CYCLIC GROUP | Kowa Co., Ltd. (JP) | 2004-03-24 | — | — | EP | disclosed |
| US-6472386-B1 | Cyclic diamine compound with 5-membered ring groups | KOWA CO., LTD. (JP) | 2002-10-29 | — | — | US | disclosed |