Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 3/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.44 |
| ▸ | ESR1 | P03372 | 4/20 | 0.39 |
| ▸ | AHR | P35869 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 3/20 | 0.39 |
| ▸ | BCR | P11274 | 3/20 | 0.39 |
| ▸ | NQO2 | P16083 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | TTR | P02766 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL16953299 | 0.86 | ESR1 (0.39) | ESR1AHRKDM4EMAPTHPGD | |
| SCHEMBL16950933 | 0.85 | GCK (0.43) | KDM4EMAPTHPGDALDH1A1POLB | |
| SCHEMBL16953794 | 0.83 | KMT2A (0.38) | AHRCYP2C9ALOX5PTGS2MEN1 | |
| SCHEMBL16962138 | 0.83 | KMT2A (0.36) | KDM4EMAPTHPGDALDH1A1POLB | |
| SCHEMBL16961433 | 0.81 | MAPT (0.34) | MAPTHPGDALDH1A1POLBCYP2C9 | |
| SCHEMBL16951519 | 0.81 | FFAR4 (0.40) | MAPTHPGDPOLBMEN1NPC1 | |
| SCHEMBL16957774 | 0.81 | MAPT (0.36) | MAPTHPGDALDH1A1POLBCYP2C9 | |
| SCHEMBL16960163 | 0.81 | KDM4E (0.35) | KDM4EMAPTHPGDALDH1A1POLB | |
| SCHEMBL16954111 | 0.81 | MAOB (0.39) | MAPTHPGDPOLBCYP2C19MEN1 | |
| SCHEMBL6632392 | 0.81 | CYP1A1 (0.64) | CYP1A1CYP1B1ESR1AHRKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |