Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CSNK2B | P67870 | 4/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL324819 | 0.68 | CYP1A1 (0.37) | CNR1CYP1A1ALDH1A1 | |
| SCHEMBL3896297 | 0.66 | CSNK2B (0.41) | CSNK2BCSNK2A1MMP2CYP1A1 | |
| SCHEMBL15714788 | 0.64 | MEN1 (0.41) | IDO1MEN1PSMD14USP2PLA2G1B | |
| SCHEMBL10551238 | 0.64 | CYP1A2 (0.51) | CYP3A4CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL10553553 | 0.64 | CYP1A2 (0.51) | CYP3A4CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL10553130 | 0.64 | CYP1A2 (0.51) | CYP3A4CYP2D6TSHRCYP2C19ALDH1A1 | |
| SCHEMBL3178688 | 0.63 | ESR1 (0.63) | ESR1LMNACYP3A4CYP2D6TSHR | |
| SCHEMBL15353198 | 0.63 | ESR1 (0.63) | ESR1LMNACYP3A4CYP2D6TSHR | |
| SCHEMBL4191545 | 0.63 | ESR1 (0.63) | ESR1LMNACYP3A4CYP2D6TSHR | |
| SCHEMBL340275 | 0.63 | ESR1 (0.63) | ESR1LMNACYP3A4CYP2D6TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9287504-B2 | Semiconducting polymers | MERCK PATENT GMBH (DE) | 2016-03-15 | — | — | US | disclosed |
| EP-2591038-B1 | SEMICONDUCTING POLYMERS | MERCK PATENT GMBH (DE) | 2014-11-05 | — | — | EP | disclosed |
| US-20130175481-A1 | SEMICONDUCTING POLYMERS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2013-07-11 | — | — | US | disclosed |
| EP-2591038-A1 | SEMICONDUCTING POLYMERS | Merck Patent GmbH (DE) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012003918-A1 | SEMICONDUCTING POLYMERS | MERCK PATENT GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |