Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPY5R | Q15761 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.42 |
| ▸ | HPN | P05981 | 2/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP3 | P08254 | 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 | |
|---|---|---|---|---|
| SCHEMBL28571497 | 0.79 | CA2 (0.44) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL28578279 | 0.75 | EGFR (0.46) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL28579676 | 0.74 | KMT2A (0.46) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL28577756 | 0.74 | MMP2 (0.47) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL28581698 | 0.72 | CNR1 (0.49) | ALDH1A1MEN1KMT2AGAAKDM4E | |
| SCHEMBL28579675 | 0.72 | CA1 (0.45) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL2161085 | 0.69 | ALDH1A1 (0.62) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL2161104 | 0.69 | ALDH1A1 (0.62) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL1000596 | 0.69 | ALDH1A1 (0.62) | ALDH1A1MEN1KMT2AHPNPLAU | |
| SCHEMBL15368932 | 0.68 | ALDH1A1 (0.60) | ALDH1A1MEN1KMT2AHPNPLAU |
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-110066231-B | Aza beta-substituted Morita-Baylis-Hillman type compound and synthetic method thereof | 江苏师范大学 | 2021-06-25 | — | — | CN | disclosed |