Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.44 |
| ▸ | TUBB | P07437 | 3/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.44 |
| ▸ | TUBA1C | Q9BQE3 | 3/20 | 0.44 |
| ▸ | TUBB6 | Q9BUF5 | 3/20 | 0.44 |
| ▸ | TUBB2B | Q9BVA1 | 3/20 | 0.44 |
| ▸ | TUBB1 | Q9H4B7 | 3/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29672073 | 1.00 | ERN1 (0.45) | ERN1HTTTUBB4ATUBBTUBA3C | |
| SCHEMBL6535962 | 0.84 | ALDH1A1 (0.40) | ERN1HTTALDH1A1KDM4EMEN1 | |
| SCHEMBL6536016 | 0.82 | ERN1 (0.50) | ERN1HTTTUBB4ATUBBTUBA3C | |
| SCHEMBL11765338 | 0.82 | ALDH1A1 (0.39) | ERN1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29672061 | 0.79 | HTT (0.44) | HTTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29672070 | 0.79 | HTT (0.44) | HTTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL29672067 | 0.79 | ERN1 (0.57) | ERN1 | |
| SCHEMBL28792537 | 0.79 | ERN1 (0.57) | ERN1 | |
| SCHEMBL205626 | 0.79 | PDE4B (0.50) | HTTTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL28635052 | 0.79 | ERN1 (0.47) | ERN1HTTALDH1A1POLBRAB9A |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112961041-A | Catechol compound and preparation method and application thereof | 心远(广州)药物研究有限公司 | 2021-06-15 | — | — | CN | claimed |
| CN-114805674-B | Polymeric phosphine ligands, transition metal complexes comprising same, preparation and use thereof | 中国科学院上海有机化学研究所 | 2023-08-11 | — | — | CN | disclosed |
| CN-112961041-B | Catechol compound and preparation method and application thereof | 心远(广州)药物研究有限公司 | 2022-06-21 | — | — | CN | disclosed |
| CN-112961041-A | Catechol compound and preparation method and application thereof | 心远(广州)药物研究有限公司 | 2021-06-15 | — | — | CN | disclosed |
| EP-1425015-A4 | TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS | BRISTOL MYERS SQUIBB CO (US) | 2004-12-15 | — | — | EP | disclosed |
| EP-1425015-A2 | TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2004-06-09 | — | — | EP | disclosed |
| WO-2003015715-A2 | TETRAHYDROQUINOLINE DERIVATIVES AS ANTITHROMBOTIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2003-02-27 | — | — | WO | disclosed |