Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.54 |
| ▸ | CA2 | P00918 | 5/20 | 0.54 |
| ▸ | CA12 | O43570 | 4/20 | 0.54 |
| ▸ | CA7 | P43166 | 4/20 | 0.54 |
| ▸ | CA9 | Q16790 | 4/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.54 |
| ▸ | ESR1 | P03372 | 5/20 | 0.48 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27697235 | 0.91 | CA4 (0.42) | CA1CA2CA12CA7CA9 | |
| SCHEMBL7647202 | 0.83 | TSHR (0.52) | CA1CA2CA12CA7CA9 | |
| SCHEMBL28146896 | 0.81 | LMNA (0.50) | MEN1KMT2ALMNAMAPTPKM | |
| SCHEMBL418469 | 0.81 | TDP1 (0.57) | MEN1KMT2ALMNAMAPTPKM | |
| SCHEMBL414308 | 0.80 | LMNA (0.56) | CA1CA12CA9KMT2ALMNA | |
| SCHEMBL7187812 | 0.78 | LMNA (0.54) | CA1CA12CA9KMT2ALMNA | |
| SCHEMBL31197306 | 0.78 | LMNA (0.54) | CA1CA12CA9KMT2ALMNA | |
| SCHEMBL6932070 | 0.78 | LMNA (0.54) | CA1CA12CA9KMT2ALMNA | |
| Water SCHEMBL18760058 | 0.78 | LMNA (0.54) | CA1CA12CA9KMT2ALMNA | |
| SCHEMBL28303591 | 0.78 | LMNA (0.54) | CA1CA12CA9KMT2ALMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106620700-B | Compound and application thereof | 中国科学院长春光学精密机械与物理研究所 | 2020-07-24 | — | — | CN | disclosed |
| EP-0172961-B1 | 1-BUTENE POLYMER AND ITS USE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1988-10-19 | — | — | EP | disclosed |