Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 9/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1117215 | 0.92 | ESR1 (0.49) | ESR1ESR2KDM4EMAPTTDP1 | |
| SCHEMBL4316535 | 0.91 | ESR1 (0.55) | ESR1ESR2KDM4EMAPTTDP1 | |
| Benz(B)Anthracene SCHEMBL11214746 | 0.91 | ESR1 (0.59) | ESR1ESR2KDM4EMAPTTDP1 | |
| SCHEMBL5470663 | 0.89 | ESR1 (0.58) | ESR1ESR2KDM4EMAPTTDP1 | |
| Anthracene SCHEMBL8502505 | 0.88 | ESR1 (0.61) | ESR1ESR2KDM4EMAPTTDP1 | |
| SCHEMBL1974251 | 0.87 | ESR1 (0.47) | ESR1ESR2KDM4EMAPTTDP1 | |
| SCHEMBL28808096 | 0.86 | ESR1 (0.60) | ESR1ESR2KDM4EMAPTTDP1 | |
| SCHEMBL9502233 | 0.86 | ESR1 (0.44) | ESR1ESR2KDM4EMAPTMAPK1 | |
| SCHEMBL2336005 | 0.85 | MAPT (0.48) | ESR1ESR2KDM4EMAPTTDP1 | |
| SCHEMBL3177146 | 0.85 | ESR1 (0.46) | ESR1ESR2KDM4EALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102884068-A | Thienopyridine derivative, method for producing same and organic semiconductor device using same | UNIV HIROSHIMA | 2013-01-16 | — | — | CN | disclosed |
| US-20100028681-A1 | Pristine and Functionalized Graphene Materials | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2010-02-04 | — | — | US | disclosed |
| WO-2008059342-A2 | METHOD OF TREATING A MATERIAL, THE SO OBTAINED TREATED MATERIAL AND DEVICES CONTAINING SAID MATERIAL | ALMA MATER STUDIORUM - UNIVERSITA' DI BOLOGNA (IT) | 2008-05-22 | — | — | WO | disclosed |