Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 7/20 | 0.53 |
| ▸ | F2RL3 | Q96RI0 | 6/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL2122737 | 0.92 | PIK3CA (0.58) | PIK3CAF2RL3CTSSCTSKPIK3CD | |
| SCHEMBL532458 | 0.85 | PIK3CA (0.71) | PIK3CAKDM4EALDH1A1HPGDHIF1A | |
| SCHEMBL2122634 | 0.84 | PIK3CA (0.59) | PIK3CAF2RL3KDM4EALDH1A1HPGD | |
| SCHEMBL2121456 | 0.84 | PIK3CA (0.71) | PIK3CAKDM4EALDH1A1HPGDHIF1A | |
| SCHEMBL532220 | 0.80 | PIK3CA (0.59) | PIK3CAF2RL3KDM4EALDH1A1HPGD | |
| SCHEMBL532711 | 0.78 | PIK3CA (0.44) | PIK3CAF2RL3PIK3CDPIK3CBPIK3CG | |
| SCHEMBL2122734 | 0.78 | PIK3CA (0.76) | PIK3CAKDM4EALDH1A1HPGDHIF1A | |
| SCHEMBL532281 | 0.75 | PIK3CA (0.72) | PIK3CAF2RL3KDM4EALDH1A1HPGD | |
| SCHEMBL532218 | 0.73 | TGFBR1 (0.46) | PIK3CAKDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL532581 | 0.72 | PIK3CA (0.59) | PIK3CAF2RL3KDM4EALDH1A1HPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2414369-A1 | IMIDAZO [2, 1-B][ 1, 3, 4]THIADIAZOLE DERIVATIVES | Centro Nacional de Investigaciones Oncológicas (CNIO) (ES) | 2012-02-08 | — | — | EP | disclosed |
| WO-2010112874-A1 | IMIDAZO [2, 1-B] [ 1, 3, 4 ] THIADIAZOLE DERIVATIVES | CENTRO NACIONAL DE INVESTIGACIONES ONCOLOGICAS (CNIO) (ES) | 2010-10-07 | — | — | WO | disclosed |