Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 4/20 | 0.47 |
| ▸ | ANPEP | P15144 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PEPD | P12955 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL318353 | 1.00 | MMP2 (0.47) | MMP2ANPEPTSHRALDH1A1BRD4 | |
| SCHEMBL19899277 | 0.82 | MMP2 (0.49) | MMP2ANPEPTSHRALDH1A1POLB | |
| SCHEMBL1833567 | 0.82 | MMP2 (0.41) | MMP2ANPEPTSHRALDH1A1POLB | |
| SCHEMBL996114 | 0.82 | ALDH1A1 (0.59) | MMP2ANPEPALDH1A1KMT2APEPD | |
| SCHEMBL10061040 | 0.82 | ALDH1A1 (0.59) | MMP2ANPEPALDH1A1KMT2APEPD | |
| SCHEMBL996111 | 0.82 | ALDH1A1 (0.59) | MMP2ANPEPALDH1A1KMT2APEPD | |
| SCHEMBL996113 | 0.82 | ALDH1A1 (0.59) | MMP2ANPEPALDH1A1KMT2APEPD | |
| SCHEMBL993099 | 0.82 | MMP2 (0.67) | MMP2ANPEPTSHRALDH1A1BRD4 | |
| SCHEMBL542252 | 0.82 | MMP2 (0.67) | MMP2ANPEPTSHRALDH1A1BRD4 | |
| SCHEMBL542253 | 0.82 | MMP2 (0.67) | MMP2ANPEPTSHRALDH1A1BRD4 |
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-117279933-A | Cyclic compounds having selective KRAS inhibition relative to HRAS and NRAS | 中外制药株式会社 | 2023-12-22 | — | — | CN | disclosed |