Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 13/20 | 0.55 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA4 | P22748 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| SCHEMBL16670822 | 0.94 | BTK (0.56) | BTKCA12CA1CA2CA4 | |
| SCHEMBL16670054 | 0.90 | BTK (0.70) | BTK | |
| SCHEMBL16670664 | 0.89 | BTK (0.56) | BTKCA12CA1CA2CA4 | |
| SCHEMBL16676753 | 0.89 | BTK (0.52) | BTKCA12CA1CA2CA4 | |
| SCHEMBL18044925 | 0.89 | BTK (0.56) | BTKCA12CA1CA2CA4 | |
| SCHEMBL16670904 | 0.87 | BTK (0.49) | BTKCA12CA1CA2CA4 | |
| SCHEMBL16670710 | 0.86 | BTK (0.45) | BTKSYK | |
| SCHEMBL16671599 | 0.85 | BTK (0.71) | BTK | |
| SCHEMBL16671450 | 0.84 | BTK (0.64) | BTKSYK | |
| SCHEMBL16671485 | 0.84 | BTK (0.44) | BTKSYK |
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-105939998-B | Heteroaryl compound and application thereof as BTK inhibitor | 默克专利有限公司 | 2019-04-16 | — | — | CN | disclosed |
| CN-105939998-A | Heteroaryl compounds as btk inhibitors and uses thereof | 默克专利有限公司 | 2016-09-14 | — | — | CN | disclosed |