Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | ERN1 | O75460 | 1/20 | 0.32 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 4/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | STAT1 | P42224 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14627744 | 0.80 | ALDH1A1 (0.35) | MEN1KMT2AKDM4EMAPTALDH1A1 | |
| SCHEMBL21984194 | 0.80 | ALDH1A1 (0.35) | MEN1KMT2AKDM4EMAPTALDH1A1 | |
| SCHEMBL2044950 | 0.73 | KDM4E (0.40) | CYP2A6MEN1KMT2AKDM4EMAPT | |
| SCHEMBL2048237 | 0.73 | CYP2A6 (0.38) | CYP2A6MEN1KMT2AKDM4EMAPT | |
| SCHEMBL7992611 | 0.69 | DHODH (0.49) | MEN1KMT2AKDM4EMAPTALDH1A1 | |
| SCHEMBL3322880 | 0.66 | CYP2A6 (0.50) | CYP2A6MEN1KMT2AKDM4EMAPT | |
| SCHEMBL557625 | 0.66 | CYP2A6 (0.50) | CYP2A6MEN1KMT2AKDM4EMAPT | |
| SCHEMBL23312077 | 0.66 | CYP2A6 (0.68) | CYP2A6MEN1KMT2AKDM4EMAPT | |
| SCHEMBL148642 | 0.66 | CYP2A6 (0.68) | CYP2A6MEN1KMT2AKDM4EMAPT | |
| SCHEMBL17849092 | 0.66 | CYP2A6 (0.68) | CYP2A6MEN1KMT2AKDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010036551-A1 | HEPATITIS C VIRUS INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2010-04-01 | — | — | WO | disclosed |