Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | CES1 | P23141 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL9557877 | 1.00 | CES2 (0.49) | CES2CES1POLBCYP1B1MAOB | |
| SCHEMBL9557820 | 0.94 | TRPA1 (0.42) | CES2CES1POLBALOX15TSHR | |
| SCHEMBL8174989 | 0.90 | POLB (0.50) | POLBTSHRKMT2AALDH1A1 | |
| SCHEMBL9556950 | 0.88 | ALDH1A1 (0.43) | POLBMEN1KMT2AMAPTALDH1A1 | |
| SCHEMBL9558207 | 0.88 | ACLY (0.44) | POLBLMNAMEN1KMT2AMAPT | |
| SCHEMBL9557392 | 0.88 | CES2 (0.51) | CES2CES1POLBMAOBTSHR | |
| SCHEMBL9557624 | 0.88 | CES2 (0.51) | CES2CES1POLBMAOBTSHR | |
| SCHEMBL9557381 | 0.87 | ABCB1 (0.47) | POLBMAOBMAPTALDH1A1 | |
| SCHEMBL9557598 | 0.87 | ABCB1 (0.47) | POLBMAOBMAPTALDH1A1 | |
| SCHEMBL9557219 | 0.86 | CYP2C19 (0.39) | CES2CES1POLBALOX15TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5225443-A | Lepidotera and Coleoptera insecticides to protect plants | ROHM AND HAAS COMPANY (US) | 1993-07-06 | — | — | US | disclosed |
| EP-0245950-A2 | Insecticidal n-substituted-n' - substituted-n, n'-diacylhydrazines | ROHM AND HAAS COMPANY (US) | 1987-11-19 | — | — | EP | disclosed |