Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | ANPEP | P15144 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3634282 | 0.90 | CA1 (0.44) | CA1CA2ALDH1A1KDM4EPTPN1 | |
| SCHEMBL3632654 | 0.88 | CA1 (0.65) | CA1CA2HPRT1CYP1B1CYP1A2 | |
| SCHEMBL29131409 | 0.88 | CA1 (0.65) | CA1CA2HPRT1CYP1B1CYP1A2 | |
| SCHEMBL1343465 | 0.85 | CA1 (0.69) | CA1CA2HPRT1CYP1B1CYP1A2 | |
| SCHEMBL2128868 | 0.83 | HPRT1 (0.64) | HPRT1CYP1B1CYP1A2CYP1A1ALDH1A1 | |
| SCHEMBL1093414 | 0.83 | HPRT1 (0.64) | HPRT1CYP1B1CYP1A2CYP1A1ALDH1A1 | |
| SCHEMBL12310187 | 0.81 | CA1 (0.65) | CA1CA2HPRT1CYP1B1CYP1A2 | |
| SCHEMBL12320895 | 0.81 | CA1 (0.65) | CA1CA2HPRT1CYP1B1CYP1A2 | |
| SCHEMBL1344052 | 0.79 | CA1 (0.67) | CA1CA2HPRT1CYP1B1CYP1A2 | |
| SCHEMBL18934329 | 0.79 | CA1 (0.53) | CA1CA2ALDH1A1KDM4ECYP2A6 |
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-2150599-A1 | CHRYSENES FOR GREEN LUMINESCENT APPLICATIONS | E. I. Du Pont de Nemours and Company (US) | 2010-02-10 | — | — | EP | disclosed |
| WO-2008150940-A1 | CHRYSENES FOR GREEN LUMINESCENT APPLICATIONS | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2008-12-11 | — | — | WO | disclosed |