Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR2 | P41597 | 4/20 | 0.55 |
| ▸ | DAO | P14920 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.42 |
| ▸ | PLA2G4A | P47712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7492984 | 0.85 | CCR2 (0.57) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL5265082 | 0.83 | MCL1 (0.53) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL4542678 | 0.81 | MCL1 (0.57) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL30310709 | 0.81 | MCL1 (0.57) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL4539369 | 0.81 | MCL1 (0.50) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL1429102 | 0.78 | DAO (0.51) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL29890647 | 0.77 | SRC (0.48) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL1422436 | 0.76 | CCR2 (0.74) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL4445494 | 0.75 | MCL1 (0.62) | CCR2DAOMCL1ALDH1A1TSHR | |
| SCHEMBL7246468 | 0.75 | DAO (0.48) | CCR2DAOMCL1ALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0885186-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | Dr. Karl Thomae GmbH (DE) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997019911-A1 | AMINO ACID DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS AND PROCESSES FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1997-06-05 | — | — | WO | disclosed |