Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29195125 | 0.87 | MAPT (0.42) | ALDH1A1HPGDNPC1RAB9ALMNA | |
| SCHEMBL30833151 | 0.87 | MAPT (0.42) | ALDH1A1HPGDNPC1RAB9ALMNA | |
| SCHEMBL8405748 | 0.84 | ALDH1A1 (0.52) | ALDH1A1HPGDNPC1RAB9ACYP2D6 | |
| SCHEMBL482018 | 0.80 | MAPT (0.43) | ALDH1A1HPGDNPC1RAB9ARECQL | |
| SCHEMBL5054217 | 0.79 | ALDH1A1 (0.41) | ALDH1A1HPGDNPC1RAB9ARECQL | |
| SCHEMBL31253883 | 0.77 | ALDH1A1 (0.54) | ALDH1A1HPGDNPC1RAB9ARECQL | |
| SCHEMBL13474908 | 0.77 | ALDH1A1 (0.54) | ALDH1A1HPGDNPC1RAB9ARECQL | |
| SCHEMBL4111905 | 0.77 | ALDH1A1 (0.54) | ALDH1A1HPGDNPC1RAB9ARECQL | |
| SCHEMBL187211 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HPGDNPC1RAB9ACYP2D6 | |
| SCHEMBL188196 | 0.77 | ALDH1A1 (0.46) | ALDH1A1HPGDNPC1RAB9ACYP2D6 |
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-105130912-A | Erlotinib preparation method suitable for industrial production | HAINAN CHUNTCH PHARMACEUTICAL CO LTD | 2015-12-09 | — | — | CN | disclosed |