Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 4/20 | 0.48 |
| ▸ | MMP12 | P39900 | 4/20 | 0.48 |
| ▸ | MMP1 | P03956 | 4/20 | 0.48 |
| ▸ | MMP9 | P14780 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | STAT1 | P42224 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL18322242 | 0.80 | KDM4E (0.49) | MMP2KMT2ALMNARAB9AALDH1A1 | |
| SCHEMBL7682150 | 0.76 | LMNA (0.52) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL22479151 | 0.75 | ALDH1A1 (0.49) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL3964905 | 0.74 | IDO1 (0.61) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL30741601 | 0.74 | IDO1 (0.61) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL22479156 | 0.74 | KDM4E (0.48) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL27574695 | 0.73 | IDO1 (0.60) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL7688984 | 0.72 | SRD5A2 (0.51) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL22939051 | 0.72 | KDM4E (0.70) | MMP2MMP12MMP1MMP9KMT2A | |
| SCHEMBL29882535 | 0.72 | GABRA1 (0.40) | — |
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-114945571-A | Cyclic compounds and methods of use thereof | 薛定谔公司 | 2022-08-26 | — | — | CN | disclosed |