Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | METAP2 | P50579 | 1/20 | 0.33 |
| ▸ | METAP1 | P53582 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | PI4KA | P42356 | 2/20 | 0.32 |
| ▸ | PI4K2B | Q8TCG2 | 2/20 | 0.32 |
| ▸ | PI4K2A | Q9BTU6 | 2/20 | 0.32 |
| ▸ | PI4KB | Q9UBF8 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | DRD3 | P35462 | 1/20 | 0.32 |
| ▸ | XDH | P47989 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | G6PD | P11413 | 1/20 | 0.31 |
| ▸ | CDC7 | O00311 | 1/20 | 0.30 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Purine SCHEMBL27783130 | 0.98 | ALDH1A1 (0.39) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL27261924 | 0.89 | ALDH1A1 (0.45) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL27811387 | 0.89 | ALDH1A1 (0.45) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL27516942 | 0.87 | ALDH1A1 (0.44) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL28550504 | 0.87 | ALDH1A1 (0.44) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL27530043 | 0.87 | ALDH1A1 (0.44) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL6421380 | 0.87 | ALDH1A1 (0.47) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL30862524 | 0.87 | — | — | |
| Purine SCHEMBL29703771 | 0.87 | ALDH1A1 (0.47) | ALDH1A1KDM4ECDK2METAP2METAP1 | |
| Purine SCHEMBL29365913 | 0.87 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102770415-A | Polycyclic compounds as lysophosphatidic acid receptor antagonists | AMIRA PHARMACEUTICALS INC | 2012-11-07 | — | — | CN | disclosed |
| CN-101291924-A | Isoindole-imide compounds and compositions comprising and methods of using the same | CELGENE CORP (US) | 2008-10-22 | — | — | CN | disclosed |
| CN-101137370-A | Liquid formulations for treating diseases or conditions | MACUSIGHT INC (US) | 2008-03-05 | — | — | CN | disclosed |