Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | NR2E1 | Q9Y466 | 5/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.54 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.54 |
| ▸ | HTR2B | P41595 | 3/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.54 |
| ▸ | HTR2A | P28223 | 3/20 | 0.54 |
| ▸ | HTR2C | P28335 | 3/20 | 0.54 |
| ▸ | HTR6 | P50406 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.54 |
| ▸ | SCN1A | P35498 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL29437208 | 0.85 | CYP1A2 (0.83) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL1394219 | 0.85 | CYP1A2 (0.83) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL8915412 | 0.81 | NR2E1 (0.57) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL17991056 | 0.81 | CYP1A2 (0.71) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL2111572 | 0.80 | KIF11 (0.50) | CYP2C19CYP2D6ALDH1A1LMNATSHR | |
| SCHEMBL14493155 | 0.78 | NR2E1 (0.73) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL29437209 | 0.77 | CYP1A2 (1.00) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL6483890 | 0.77 | CYP1A2 (1.00) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL6483883 | 0.77 | CYP1A2 (1.00) | CYP1A2MEN1KMT2ACYP2C19KDM4E | |
| SCHEMBL8566653 | 0.77 | CYP1A2 (1.00) | CYP1A2MEN1KMT2ACYP2C19KDM4E |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5614548-A | TREATING TUMORS AND HIV INFECTION, PROTEIN KINASE C INHIBITORS | WAKE FOREST UNIVERSITY (US) | 1997-03-25 | — | — | US | disclosed |