Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 10/20 | 0.47 |
| ▸ | MMP1 | P03956 | 6/20 | 0.47 |
| ▸ | MMP3 | P08254 | 6/20 | 0.47 |
| ▸ | MMP7 | P09237 | 6/20 | 0.47 |
| ▸ | MMP9 | P14780 | 6/20 | 0.47 |
| ▸ | MMP13 | P45452 | 6/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPN | P05981 | 2/20 | 0.44 |
| ▸ | PLAU | P00749 | 1/20 | 0.44 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.44 |
| ▸ | METAP2 | P50579 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28579676 | 0.88 | KMT2A (0.46) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28578279 | 0.86 | EGFR (0.46) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28581698 | 0.85 | CNR1 (0.49) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28587826 | 0.85 | NHERF1 (0.44) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28571497 | 0.81 | CA2 (0.44) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28579675 | 0.80 | CA1 (0.45) | MEN1KMT2AALDH1A1HPNPLAU | |
| SCHEMBL28571500 | 0.76 | CNR1 (0.49) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28592830 | 0.74 | NPY5R (0.43) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL29019311 | 0.74 | CNR1 (0.54) | MMP2MMP1MMP3MMP7MMP9 | |
| SCHEMBL28585258 | 0.73 | EGFR (0.44) | MMP2MMP1MMP3MMP7MMP9 |
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 |