Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | NQO1 | P15559 | 1/20 | 0.34 |
| ▸ | ABL1 | P00519 | 1/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | BCR | P11274 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL337732 | 0.63 | BACE1 (0.73) | BACE1NQO1ABL1ABCB1BCR | |
| SCHEMBL10051846 | 0.60 | BACE1 (0.67) | BACE1NQO1ABL1ABCB1BCR | |
| Hydrogen Sulfide SCHEMBL8888923 | 0.60 | BACE1 (0.67) | BACE1NQO1ABL1ABCB1BCR | |
| Phloroglucinol SCHEMBL2889628 | 0.59 | BACE1 (1.00) | BACE1NQO1ABL1ABCB1BCR | |
| Phloroglucinol SCHEMBL26311 | 0.59 | — | — | |
| Phloroglucinol SCHEMBL30542958 | 0.59 | — | — | |
| SCHEMBL15747940 | 0.57 | HSD17B1 (0.56) | BACE1NQO1ABL1ABCB1BCR | |
| SCHEMBL2090666 | 0.57 | BACE1 (0.50) | BACE1NQO1ABL1ABCB1BCR | |
| SCHEMBL2090372 | 0.56 | ABL1 (0.88) | BACE1NQO1ABL1ABCB1BCR | |
| Phloroglucinol SCHEMBL23346245 | 0.56 | BACE1 (0.89) | BACE1NQO1ABL1ABCB1BCR |
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 |
|---|---|---|---|---|---|---|---|
| US-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |