Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.49 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.49 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | PTPRC | P08575 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 6/20 | 0.43 |
| ▸ | HTR2B | P41595 | 6/20 | 0.43 |
| ▸ | EDNRB | P24530 | 1/20 | 0.43 |
| ▸ | EDNRA | P25101 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CDC25A | P30304 | 1/20 | 0.39 |
| ▸ | CDC25B | P30305 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15937977 | 0.87 | CYP1A2 (0.49) | CYP1A2MAPK1SRD5A2SRD5A1PTPRC | |
| SCHEMBL13855743 | 0.78 | ATM (0.52) | SRD5A2PTPRCKMT2AMEN1ALDH1A1 | |
| SCHEMBL13855345 | 0.78 | ATM (0.52) | SRD5A2PTPRCKMT2AMEN1ALDH1A1 | |
| SCHEMBL30184247 | 0.76 | HTR2B (0.63) | SRD5A2SRD5A1TTRPTPRCKMT2A | |
| SCHEMBL4921360 | 0.74 | KMT2A (0.44) | SRD5A2SRD5A1TTRPTPRCKMT2A | |
| SCHEMBL14675599 | 0.74 | CYP1A2 (0.46) | CYP1A2MAPK1PTPRCKMT2AGAA | |
| SCHEMBL30571871 | 0.74 | HTR7 (0.62) | SRD5A2SRD5A1TTRPTPRCKMT2A | |
| SCHEMBL7825562 | 0.74 | HTR7 (0.62) | SRD5A2SRD5A1TTRPTPRCKMT2A | |
| SCHEMBL14124766 | 0.74 | EDNRB (0.50) | CYP1A2MAPK1SRD5A2SRD5A1PTPRC | |
| SCHEMBL15937786 | 0.74 | MAPK1 (0.44) | CYP1A2MAPK1KMT2AMEN1ALDH1A1 |
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-9780311-B2 | Compounds for electronic devices | MERCK PATENT GMBH (DE) | 2017-10-03 | — | — | US | disclosed |
| US-20140225040-A1 | COMPOUNDS FOR ELECTRONIC DEVICES | MERCK PATENT GMBH PATENTS & SCIENTIFIC INFORMATION (DE) | 2014-08-14 | — | — | US | disclosed |