Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | NQO2 | P16083 | 2/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8019923 | 0.80 | ALDH1A1 (0.50) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10051168 | 0.75 | ACHE (0.46) | ACHEPTPN1NQO2CYP19A1CA12 | |
| SCHEMBL15488875 | 0.73 | ACHE (0.41) | ACHEPTPN1NQO2CYP19A1CA12 | |
| SCHEMBL7187825 | 0.70 | CYP3A4 (0.41) | NQO2CYP19A1ALDH1A1KDM4ELMNA | |
| SCHEMBL7190082 | 0.70 | CYP3A4 (0.44) | NQO2CYP19A1LMNAGAAHPGD | |
| SCHEMBL1486338 | 0.70 | RAPGEF4 (0.43) | ACHECA1CA2ALDH1A1KDM4E | |
| SCHEMBL15120000 | 0.69 | ALDH1A1 (0.52) | ACHENQO2CYP19A1CA12CA1 | |
| SCHEMBL12141429 | 0.69 | ALDH1A1 (0.48) | NQO2CYP19A1CA12CA1CA2 | |
| SCHEMBL13976591 | 0.68 | CYP2D6 (0.40) | ACHEPTPN1CA12CA1CA2 | |
| SCHEMBL3318963 | 0.68 | ACHE (0.46) | ACHECA12CA1CA2CA7 |
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 |
|---|---|---|---|---|---|---|---|
| US-9303101-B2 | Catalyst for synthesizing polyolefins | THE UNIVERSITY OF TOKYO (JP) | 2016-04-05 | — | — | US | disclosed |
| US-20150099857-A1 | CATALYST FOR SYNTHESIZING POLYOLEFINS | SHOWA DENKO K.K. (JP) | 2015-04-09 | — | — | US | disclosed |