Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.46 |
| ▸ | CASP7 | P55210 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22897788 | 1.00 | VCAM1 (0.58) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| SCHEMBL8000314 | 0.88 | VCAM1 (0.61) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| SCHEMBL559830 | 0.88 | VCAM1 (0.64) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| SCHEMBL30525281 | 0.88 | VCAM1 (0.64) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| Methane SCHEMBL27578247 | 0.86 | VCAM1 (0.62) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| SCHEMBL2116235 | 0.85 | VCAM1 (0.61) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| SCHEMBL5548331 | 0.85 | VCAM1 (0.54) | VCAM1HPGDALDH1A1NPSR1LMNA | |
| SCHEMBL22897616 | 0.84 | MAPT (0.51) | VCAM1ALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL29559260 | 0.84 | MAPT (0.51) | VCAM1ALDH1A1LMNAPOLBKMT2A | |
| SCHEMBL22897619 | 0.84 | TSHR (0.45) | VCAM1ALDH1A1LMNAPOLBKDM4E |
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-114072000-A | Molecules having certain pesticidal effects and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2022-02-18 | — | — | CN | disclosed |