Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.51 |
| ▸ | ACP3 | P15309 | 2/20 | 0.51 |
| ▸ | PPARG | P37231 | 3/20 | 0.48 |
| ▸ | PNMT | P11086 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | TDO2 | P48775 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28079203 | 0.98 | CES2 (0.50) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL15019058 | 0.92 | CES2 (0.55) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL18952889 | 0.90 | CES2 (0.57) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL15019335 | 0.88 | CES2 (0.55) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL15019153 | 0.88 | CES2 (0.55) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL21343262 | 0.86 | CES2 (0.50) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL4748398 | 0.84 | CES2 (0.51) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL8538670 | 0.84 | CES2 (0.51) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL19541387 | 0.82 | CES2 (0.47) | CES2ACP3PPARGPNMTMEN1 | |
| SCHEMBL4077713 | 0.80 | CES2 (0.54) | CES2ACP3PPARGPNMTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017097870-A1 | SUBSTITUTED MALONIC ACID AMIDES AS INSECTICIDES | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2017-06-15 | — | — | WO | disclosed |