Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | EGFR | P00533 | 2/20 | 0.50 |
| ▸ | HPGDS | O60760 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | NCF1 | P14598 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | NQO2 | P16083 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.45 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL622376 | 0.77 | ALDH1A1 (0.56) | ALDH1A1GFERKDM4EEGFRHPGDS | |
| SCHEMBL483893 | 0.76 | NCF1 (0.68) | ALDH1A1GFERKDM4EEGFRKMT2A | |
| SCHEMBL1640918 | 0.75 | NQO1 (0.63) | ALDH1A1GFERKDM4EEGFRHPGDS | |
| SCHEMBL13347627 | 0.75 | KMT2A (0.49) | ALDH1A1KDM4EKMT2AL3MBTL1MEN1 | |
| SCHEMBL11601649 | 0.74 | ALDH1A1 (0.56) | ALDH1A1GFERKDM4EEGFRKMT2A | |
| Hydrochloric Acid SCHEMBL27511022 | 0.74 | NCF1 (0.66) | ALDH1A1GFERKDM4EEGFRKMT2A | |
| SCHEMBL18571753 | 0.74 | ALDH1A1 (0.66) | ALDH1A1GFERKDM4EEGFRHPGDS | |
| SCHEMBL12068392 | 0.74 | ALDH1A1 (0.57) | ALDH1A1GFERKDM4EEGFRHPGDS | |
| SCHEMBL10963624 | 0.74 | PIK3CG (0.48) | ALDH1A1KDM4EKMT2AMEN1LMNA | |
| SCHEMBL31403537 | 0.74 | HPGDS (0.55) | ALDH1A1KDM4EHPGDSKMT2ANPC1 |
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-104918941-A | Hepatitis c virus inhibitors | BRISTOL MYERS SQUIBB CO | 2015-09-16 | — | — | CN | disclosed |