Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6750038 | 0.82 | NQO1 (0.35) | ALDH1A1HSD17B10KDM4ECYP1A2HPGD | |
| SCHEMBL2961141 | 0.81 | MAPK1 (0.33) | ALDH1A1HSD17B10TSHRTDP1 | |
| SCHEMBL6751438 | 0.81 | ALDH1A1 (0.35) | ALDH1A1HSD17B10CYP1A2HPGD | |
| SCHEMBL6748578 | 0.79 | CYP1A2 (0.35) | ALDH1A1HSD17B10CYP1A2TSHRTDP1 | |
| SCHEMBL15302884 | 0.78 | ALDH1A1 (0.43) | ALDH1A1CYP2A6HSD17B10KDM4ECYP1A2 | |
| SCHEMBL6751482 | 0.77 | ALDH1A1 (0.44) | ALDH1A1HSD17B10KDM4ECYP1A2CYP2D6 | |
| SCHEMBL6751517 | 0.74 | CYP1A2 (0.42) | ALDH1A1HSD17B10CYP1A2TSHRTDP1 | |
| SCHEMBL6748536 | 0.74 | CYP1A2 (0.43) | ALDH1A1HSD17B10KDM4ECYP1A2TSHR | |
| SCHEMBL704261 | 0.74 | ACHE (0.38) | ALDH1A1TSHRTDP1CYP3A4ACHE | |
| SCHEMBL15301990 | 0.73 | HPGD (0.40) | ALDH1A1CYP2A6HSD17B10KDM4ECYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107076894-A | Infrared shielding composition, cured film, and solid-state imaging device | JSR株式会社 | 2017-08-18 | — | — | CN | disclosed |
| CN-105593234-A | Novel organopolysiloxane, surface treatment agent comprising the same, resin composition comprising the same, and gelatinous product or cured product thereof | DOW CORNING TORAY CO LTD | 2016-05-18 | — | — | CN | disclosed |
| WO-2015023001-A1 | NOVEL ORGANOPOLYSILOXANE, SURFACE TREATMENT AGENT COMPRISING THE SAME, RESIN COMPOSITION COMPRISING THE SAME, AND GELATINOUS PRODUCT OR CURED PRODUCT THEREOF | DOW CORNING TORAY CO., LTD. (JP) | 2015-02-19 | — | — | WO | disclosed |