Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | SYK | P43405 | 12/20 | 0.46 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 2/20 | 0.41 |
| ▸ | CDC7 | O00311 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | FER | P16591 | 2/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.40 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 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 | |
|---|---|---|---|---|
| SCHEMBL4064611 | 1.00 | ALDH1A1 (0.51) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL4065551 | 1.00 | ALDH1A1 (0.51) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL4065548 | 1.00 | ALDH1A1 (0.51) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL4064616 | 1.00 | ALDH1A1 (0.51) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL4064618 | 1.00 | ALDH1A1 (0.51) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL11499914 | 0.96 | ALDH1A1 (0.47) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL11496595 | 0.96 | ALDH1A1 (0.47) | ALDH1A1SYKKAT2BLMNAGAA | |
| SCHEMBL30887532 | 0.85 | ALDH1A1 (0.65) | ALDH1A1LMNAGAASMN1; SMN2 | |
| SCHEMBL5613415 | 0.81 | SYK (0.50) | ALDH1A1SYKKAT2BLMNASMN1; SMN2 | |
| SCHEMBL4437198 | 0.81 | SYK (0.50) | ALDH1A1SYKKAT2BLMNASMN1; SMN2 |
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-1317445-A2 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS | ANORMED INC. (CA) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002022600-A2 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS | ANORMED INC. (CA) | 2002-03-21 | — | — | WO | disclosed |