Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 17/20 | 0.41 |
| ▸ | CA2 | P00918 | 17/20 | 0.41 |
| ▸ | CA9 | Q16790 | 15/20 | 0.40 |
| ▸ | CA12 | O43570 | 5/20 | 0.39 |
| ▸ | CA7 | P43166 | 5/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.39 |
| ▸ | CA3 | P07451 | 4/20 | 0.39 |
| ▸ | CA4 | P22748 | 4/20 | 0.39 |
| ▸ | CA6 | P23280 | 4/20 | 0.39 |
| ▸ | CA5A | P35218 | 4/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | ODC1 | P11926 | 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 | |
|---|---|---|---|---|
| SCHEMBL27897929 | 0.95 | CA1 (0.44) | CA1CA2CA9CA12CA7 | |
| Dimethylamine SCHEMBL27602034 | 0.89 | CA1 (0.40) | CA1CA2CA9CA12CA7 | |
| SCHEMBL2321368 | 0.80 | — | — | |
| SCHEMBL27651937 | 0.80 | CA1 (0.45) | CA1CA2CA9CA12CA7 | |
| SCHEMBL575454 | 0.80 | TSHR (0.48) | CA1CA2CA9CA12CA7 | |
| SCHEMBL575603 | 0.80 | TSHR (0.55) | CA1CA2CA9CA12CA7 | |
| SCHEMBL30427933 | 0.78 | CA1 (0.39) | CA1CA2CA9CA12CA7 | |
| SCHEMBL10930002 | 0.78 | CA1 (0.39) | CA1CA2CA9CA12CA7 | |
| SCHEMBL8827678 | 0.78 | TSHR (0.42) | CA1CA2CA9CA12CA7 | |
| SCHEMBL14779186 | 0.78 | TSHR (0.52) | CA1CA2CA9CA12CA7 |
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-105452320-B | Blocked isocyanate, coating composition, adhesive composition, and article | 三井化学株式会社 | 2019-02-26 | — | — | CN | disclosed |
| CN-107325262-A | Blocked isocyanate, coating composition, adhesive composite and article | 三井化学株式会社 | 2017-11-07 | — | — | CN | disclosed |
| CN-105452320-A | Blocked isocyanate, coating composition, adhesive composition, and article | MITSU CHEMICALS INC | 2016-03-30 | — | — | CN | disclosed |