Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.39 |
| ▸ | MEN1 | O00255 | 6/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28091366 | 0.91 | KDM1A (0.45) | KDM1ACA1CA2ABCG2ABCB1 | |
| SCHEMBL28732552 | 0.85 | ACP1 (0.43) | KDM1ACA1CA2ABCG2ABCB1 | |
| SCHEMBL28091119 | 0.82 | KMT2A (0.48) | ALDH1A1KDM4EKMT2ALMNAHSD17B10 | |
| SCHEMBL28091075 | 0.82 | MAPT (0.34) | KDM1ALMNAMAPTSMN1; SMN2HIF1A | |
| SCHEMBL28091313 | 0.78 | MAOA (0.46) | KDM1AALDH1A1KDM4EKMT2AMEN1 | |
| SCHEMBL28833010 | 0.77 | KMT2A (0.39) | ABCG2ALDH1A1KDM4EADORA2AKMT2A | |
| SCHEMBL18934329 | 0.73 | CA1 (0.53) | CA1CA2ALDH1A1KDM4EKMT2A | |
| SCHEMBL31567609 | 0.73 | CA1 (0.43) | KDM1ACA1CA2ABCG2ABCB1 | |
| SCHEMBL29115342 | 0.71 | KDM1A (0.42) | KDM1ACA1CA2ABCG2ABCB1 | |
| SCHEMBL29156682 | 0.70 | KCNA5 (0.42) | KDM1ACA1CA2ABCG2ABCB1 |
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-105859620-A | 6-trichloromethyl phenanthridine compounds and preparation method and application thereof | 大连理工大学 | 2016-08-17 | — | — | CN | disclosed |