Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | HIPK4 | Q8NE63 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | HNF4A | P41235 | 2/20 | 0.35 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | HMGB1 | P09429 | 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 | |
|---|---|---|---|---|
| SCHEMBL29034609 | 0.84 | TDP1 (0.46) | MCL1ALDH1A1TSHRTDP1 | |
| SCHEMBL7557301 | 0.78 | KDM4E (0.51) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL30872150 | 0.78 | KDM4E (0.51) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL20390042 | 0.75 | LCK (0.44) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL9688332 | 0.75 | KDM4E (0.46) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL29034598 | 0.74 | PTGER1 (0.40) | MCL1 | |
| SCHEMBL7598320 | 0.73 | MAPK1 (0.49) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL29272820 | 0.73 | MYC (0.39) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL9514004 | 0.72 | ADRA2A (0.43) | ALDH1A1KDM4ETDP1 | |
| SCHEMBL9070650 | 0.72 | PTGER1 (0.42) | ALDH1A1KDM4EHPGDHSD17B10TSHR |
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-108472381-B | Compounds and therapeutic uses thereof | 森陶里治疗有限公司 | 2023-06-06 | — | — | CN | disclosed |