Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | JUN | P05412 | 1/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3351392 | 0.68 | CYP2A6 (0.42) | NNMTKDM4EALDH1A1 | |
| SCHEMBL401530 | 0.68 | OPRK1 (0.47) | KDM4EALDH1A1NFKB1NFKB2RELA | |
| SCHEMBL26739711 | 0.67 | CHRNB2 (0.40) | NNMTKDM4EALDH1A1 | |
| SCHEMBL12024798 | 0.67 | ATM (0.50) | KDM4EALDH1A1GAAATMKMT2A | |
| Hydrochloric Acid SCHEMBL28477299 | 0.67 | CYP2A6 (0.41) | NNMTKDM4EALDH1A1 | |
| SCHEMBL25323091 | 0.66 | ATR (0.49) | — | |
| SCHEMBL7472653 | 0.66 | KDM4E (0.49) | NNMTKDM4EALDH1A1ALOX15MEN1 | |
| SCHEMBL38664726 | 0.66 | CA12 (0.50) | KDM4EALDH1A1GAAATM | |
| SCHEMBL12986469 | 0.66 | P2RX7 (0.59) | KDM4EALDH1A1ALOX15 | |
| SCHEMBL20008220 | 0.65 | RRM2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104024226-B | Novel nicotinamide derivative or salt thereof | FUJIFILM CORP. (JP) | 2016-06-01 | — | — | CN | disclosed |