Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | MYC | P01106 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 4/20 | 0.49 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27314680 | 0.83 | HCRTR1 (0.50) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL30982330 | 0.81 | HCRTR1 (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19MYC | |
| SCHEMBL299870 | 0.81 | HCRTR1 (0.48) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL403908 | 0.81 | HCRTR1 (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19MYC | |
| SCHEMBL28396855 | 0.80 | CYP1A2 (0.57) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL10475608 | 0.79 | KMT2A (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL19979962 | 0.78 | CYP1A2 (0.46) | CYP1A2CYP3A4CYP2C9CYP2C19POLB | |
| SCHEMBL28397648 | 0.77 | POLB (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL8193680 | 0.77 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19KMT2A | |
| SCHEMBL27787386 | 0.77 | MYC (0.54) | MYCKMT2APOLBHCRTR1HCRTR2 |
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-113444016-A | Molecules having pesticidal utility, and intermediates, compositions and methods related thereto | 美国陶氏益农公司 | 2021-09-28 | — | — | CN | disclosed |