Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 1/20 | 0.53 |
| ▸ | AGTR2 | P50052 | 1/20 | 0.53 |
| ▸ | CCR2 | P41597 | 4/20 | 0.53 |
| ▸ | PPARG | P37231 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL15700119 | 0.88 | AGTR1 (0.57) | AGTR1AGTR2CCR2PPARGCYP19A1 | |
| SCHEMBL14386999 | 0.85 | AGTR1 (0.61) | AGTR1AGTR2CCR2PPARGCYP19A1 | |
| SCHEMBL7554153 | 0.84 | CCR2 (0.57) | AGTR1AGTR2CCR2PPARGALDH1A1 | |
| SCHEMBL4802191 | 0.80 | CCR2 (0.59) | AGTR1AGTR2CCR2PPARGCYP19A1 | |
| SCHEMBL31402270 | 0.80 | CCR2 (0.59) | AGTR1AGTR2CCR2PPARGCYP19A1 | |
| SCHEMBL30005781 | 0.79 | KMT2A (0.46) | — | |
| SCHEMBL28144657 | 0.76 | TP53 (0.52) | AGTR1AGTR2CCR2PPARGCYP19A1 | |
| SCHEMBL4438165 | 0.76 | CCR2 (0.51) | AGTR1AGTR2CCR2PPARGCYP19A1 | |
| SCHEMBL5367285 | 0.74 | AGTR1 (0.58) | AGTR1AGTR2CCR2PPARG | |
| SCHEMBL8032176 | 0.73 | CCR2 (0.63) | CCR2CYP19A1HPGDESR1KDM4E |
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-111559974-B | Seven-membered ring fused cyclopenta [ b ] indole derivative and synthesis method and application thereof | 华东师范大学 | 2022-10-25 | — | — | CN | disclosed |