Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NHERF1 | O14745 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 5/20 | 0.40 |
| ▸ | MMP1 | P03956 | 4/20 | 0.40 |
| ▸ | MMP3 | P08254 | 4/20 | 0.40 |
| ▸ | MMP7 | P09237 | 4/20 | 0.40 |
| ▸ | MMP9 | P14780 | 4/20 | 0.40 |
| ▸ | MMP13 | P45452 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28585258 | 0.89 | EGFR (0.44) | EGFRERBB2KMT2AGAAALDH1A1 | |
| SCHEMBL28572871 | 0.87 | CYP2C19 (0.51) | KMT2AGAAALDH1A1MEN1CYP2C9 | |
| SCHEMBL28577756 | 0.85 | MMP2 (0.47) | EGFRERBB2KMT2AALDH1A1MEN1 | |
| SCHEMBL4059194 | 0.81 | ALDH1A1 (0.49) | KMT2AGAAALDH1A1MEN1LMNA | |
| SCHEMBL28580040 | 0.81 | SMN1; SMN2 (0.46) | ALDH1A1LMNACYP2C9SMN1; SMN2 | |
| SCHEMBL28571500 | 0.78 | CNR1 (0.49) | EGFRKMT2AALDH1A1MEN1LMNA | |
| SCHEMBL28736947 | 0.77 | NHERF1 (0.47) | NHERF1EGFRERBB2KMT2AGAA | |
| SCHEMBL28581698 | 0.74 | CNR1 (0.49) | EGFRKMT2AGAAALDH1A1MEN1 | |
| SCHEMBL9611222 | 0.73 | ALDH1A1 (0.56) | KMT2AGAAALDH1A1MEN1LMNA | |
| SCHEMBL9611224 | 0.73 | ALDH1A1 (0.56) | KMT2AGAAALDH1A1MEN1LMNA |
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 |