Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | MMP3 | P08254 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3672942 | 0.95 | KDM4E (0.32) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL19396013 | 0.80 | POLB (0.32) | ALDH1A1POLB | |
| SCHEMBL24872447 | 0.78 | CYP2A6 (0.32) | CYP2A6 | |
| SCHEMBL27775892 | 0.78 | — | — | |
| SCHEMBL3470369 | 0.78 | — | — | |
| SCHEMBL19396012 | 0.78 | NPC1 (0.33) | POLB | |
| SCHEMBL11345316 | 0.77 | CYP2D6 (0.44) | ALDH1A1MAPTKDM4ETDP1POLB | |
| SCHEMBL1714134 | 0.77 | TDP1 (0.60) | KMT2AALDH1A1MAPTTDP1POLB | |
| SCHEMBL17541771 | 0.73 | ALDH1A1 (0.57) | MEN1KMT2AALDH1A1MAPTHPGD | |
| SCHEMBL19396010 | 0.73 | ALDH1A1 (0.34) | ALDH1A1TSHR |
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-105899585-A | Plasticizer composition containing furan derivatives and 1,2-cyclohexanedicarboxylic ester | 巴斯夫欧洲公司 | 2016-08-24 | — | — | CN | disclosed |