Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.50 |
| ▸ | ACACA | Q13085 | 2/20 | 0.49 |
| ▸ | DHODH | Q02127 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 8/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | TACR3 | P29371 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL28115474 | 0.92 | MAPT (0.60) | KDM4ESMN1; SMN2LMNAPDE10AMAPT | |
| SCHEMBL28115475 | 0.90 | MAPT (0.45) | KDM4ESMN1; SMN2LMNAPDE10AACACA | |
| SCHEMBL28837021 | 0.89 | MAPT (0.60) | KDM4ELMNADHODHMAPTALDH1A1 | |
| SCHEMBL28115074 | 0.88 | DHODH (0.54) | KDM4EDHODHMAPTALDH1A1HPGD | |
| SCHEMBL28115477 | 0.88 | RXFP1 (0.52) | KDM4ELMNAMAPTCYP2C9ALDH1A1 | |
| SCHEMBL28115022 | 0.88 | DHODH (0.53) | KDM4EACACADHODHMAPTCYP2C9 | |
| SCHEMBL28837077 | 0.85 | TRPV1 (0.43) | KDM4ELMNADHODHMAPTALDH1A1 | |
| SCHEMBL28115083 | 0.85 | MAPT (0.48) | KDM4ELMNADHODHMAPTALDH1A1 | |
| SCHEMBL28115476 | 0.85 | POLB (0.57) | KDM4ELMNAPDE10AACACAMAPT | |
| SCHEMBL28115023 | 0.85 | MAPT (0.46) | KDM4ELMNAPDE10AACACADHODH |
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-106220560-A | A kind of preparation method of poly-substituted quinoline derivant | 华侨大学 | 2016-12-14 | — | — | CN | disclosed |