Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15277878 | 0.91 | ACHE (0.38) | ACHEKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL14964002 | 0.85 | CHEK1 (0.38) | ACHEKDM4EALDH1A1MAPTHPGD | |
| SCHEMBL15281525 | 0.83 | ALDH1A1 (0.36) | ACHEKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL15279574 | 0.83 | ADORA1 (0.35) | ACHEKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL15279573 | 0.81 | DPP4 (0.43) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL19097325 | 0.77 | ALDH1A1 (0.37) | ACHEKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL14964006 | 0.76 | MAP3K8 (0.36) | KDM4EALDH1A1MAPTHPGDNPC1 | |
| SCHEMBL14964010 | 0.74 | MAP3K8 (0.35) | KDM4EALDH1A1MAPTHPGDCYP3A4 | |
| SCHEMBL14964020 | 0.72 | GSTP1 (0.42) | ACHEMAPTCYP3A4CYP2C9CYP1A2 | |
| SCHEMBL1102369 | 0.72 | NPC1 (0.35) | KDM4EMEN1KMT2AALDH1A1MAPT |
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-9394406-B2 | Polymers containing substituted benzodithiophene units, blends comprising these polymers, and devices comprising these polymers or blends | MERCK PATENT GMBH (DE) | 2016-07-19 | — | — | US | disclosed |
| US-20130126855-A1 | POLYMERS CONTAINING SUBSTITUTED BENZODITHIOPHENE UNITS, BLENDS COMPRISING THESE POLYMERS, AND DEVICES COMPRISING THESE POLYMERS OR BLENDS | MERCK PATENT GMBH (DE) | 2013-05-23 | — | — | US | disclosed |