Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMARCA2 | P51531 | 2/20 | 0.46 |
| ▸ | SMARCA4 | P51532 | 2/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.46 |
| ▸ | LOX | P28300 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CHKA | P35790 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | STAT3 | P40763 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15454569 | 1.00 | SMARCA2 (0.46) | SMARCA2SMARCA4LOXL2LOXHSD17B10 | |
| SCHEMBL2566196 | 0.81 | LOXL2 (0.46) | SMARCA2SMARCA4LOXL2LOXHSD17B10 | |
| SCHEMBL5700160 | 0.81 | SYK (0.47) | LOXL2LOXHSD17B10ALDH1A1AR | |
| Hydrochloric Acid SCHEMBL27991102 | 0.79 | LOXL2 (0.47) | SMARCA2SMARCA4LOXL2LOXHSD17B10 | |
| SCHEMBL21020612 | 0.77 | HRH4 (0.47) | SMARCA2SMARCA4LOXL2LOXKCNQ2 | |
| SCHEMBL19928748 | 0.76 | ALDH1A1 (0.43) | SMARCA2SMARCA4LOXL2HSD17B10ALDH1A1 | |
| SCHEMBL724036 | 0.75 | TDP1 (0.46) | SMARCA2SMARCA4LOXL2LOXHSD17B10 | |
| SCHEMBL27137469 | 0.74 | RXRA (0.41) | SMARCA2SMARCA4LOXL2LOXIDO1 | |
| SCHEMBL27137532 | 0.73 | RXRA (0.48) | SMARCA2SMARCA4LOXL2NOTUMAR | |
| SCHEMBL244098 | 0.72 | TRPV4 (0.52) | HSD17B10ALDH1A1TDP1TRPV4 |
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-113264945-B | Spiro derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-11-22 | — | — | CN | disclosed |