Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CCR2 | P41597 | 5/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | FABP4 | P15090 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | PLA2G2A | P14555 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22760179 | 0.91 | CCR2 (0.48) | ALDH1A1CCR2FOLH1TP53RXFP1 | |
| SCHEMBL22760113 | 0.87 | PIM1 (0.44) | ALDH1A1CCR2FOLH1TP53RXFP1 | |
| SCHEMBL22760408 | 0.79 | PIM1 (0.42) | ALDH1A1 | |
| SCHEMBL22747864 | 0.77 | CCR2 (0.46) | ALDH1A1CCR2FOLH1FABP4NOTUM | |
| SCHEMBL22760164 | 0.72 | ALDH1A1 (0.38) | ALDH1A1CCR2FOLH1TP53NOTUM | |
| SCHEMBL22747915 | 0.72 | ALDH1A1 (0.40) | ALDH1A1FOLH1FABP4 | |
| SCHEMBL22760224 | 0.72 | USP14 (0.43) | ALDH1A1FOLH1 | |
| SCHEMBL22760225 | 0.70 | FOLH1 (0.44) | ALDH1A1FOLH1 | |
| SCHEMBL22760058 | 0.70 | ALDH1A1 (0.39) | ALDH1A1TP53NOTUM | |
| SCHEMBL22760060 | 0.70 | NOTUM (0.40) | ALDH1A1FOLH1TP53NOTUM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020244462-A1 | INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2020-12-10 | — | — | WO | disclosed |