Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20555901 | 0.91 | ESR1 (0.46) | ESR1HPGDALDH1A1SMN1; SMN2POLB | |
| SCHEMBL28452996 | 0.89 | GAA (0.46) | ESR1HPGDALDH1A1MAPTKMT2A | |
| SCHEMBL27614188 | 0.84 | ESR1 (0.41) | ESR1HPGDALDH1A1KMT2A | |
| SCHEMBL24317924 | 0.76 | SMN1; SMN2 (0.46) | ESR1ALDH1A1SMN1; SMN2POLBCA12 | |
| SCHEMBL7000187 | 0.76 | SMN1; SMN2 (0.46) | ESR1ALDH1A1SMN1; SMN2POLBCA12 | |
| SCHEMBL28811178 | 0.75 | KMT2A (0.39) | ESR1HPGDALDH1A1MAPTMEN1 | |
| SCHEMBL2028142 | 0.74 | NFE2L2 (0.44) | ESR1HPGDALDH1A1SMN1; SMN2POLB | |
| SCHEMBL5270439 | 0.71 | SMN1; SMN2 (0.47) | HPGDALDH1A1SMN1; SMN2CA12CA1 | |
| SCHEMBL6829518 | 0.70 | ESR1 (0.38) | ESR1HPGDALDH1A1SMN1; SMN2POLB | |
| Propane SCHEMBL27582651 | 0.70 | SMN1; SMN2 (0.60) | HPGDALDH1A1SMN1; SMN2POLBCA12 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107964016-B | Thiophene derivatives | 天津合美医药科技有限公司 | 2021-10-01 | — | — | CN | disclosed |
| CN-108059635-B | Thiophene derivatives | 天津合美医药科技有限公司 | 2021-10-01 | — | — | CN | disclosed |
| CN-107722036-B | Thiophene derivatives | 天津合美医药科技有限公司 | 2020-09-04 | — | — | CN | disclosed |