Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 4/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.44 |
| ▸ | SYK | P43405 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | GCK | P35557 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.39 |
| ▸ | INCENP | Q9NQS7 | 2/20 | 0.39 |
| ▸ | MGMT | P16455 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7822997 | 0.81 | NUDT1 (0.56) | GRM5TLR8TLR7ALDH1A1LMNA | |
| SCHEMBL5296768 | 0.78 | MAOA (0.54) | GRM5GRM1MGMTALDH1A1L3MBTL1 | |
| SCHEMBL7833949 | 0.76 | ALDH1A1 (0.38) | ALDH1A1LMNAL3MBTL1KDM4ESMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL22612465 | 0.71 | SIRT2 (0.39) | SYKCYP1A2ALDH1A1LMNAKDM4E | |
| SCHEMBL29378197 | 0.70 | SIRT2 (0.41) | SYKCYP1A2ALDH1A1LMNAKDM4E | |
| SCHEMBL95212 | 0.70 | SIRT2 (0.41) | SYKCYP1A2ALDH1A1LMNAKDM4E | |
| SCHEMBL24265392 | 0.70 | SYK (0.55) | GRM5SYKGCKAURKBINCENP | |
| SCHEMBL4235232 | 0.70 | SYK (0.54) | GRM5SYKMGMTPARP10ALDH1A1 | |
| SCHEMBL30716906 | 0.70 | SYK (0.54) | GRM5SYKMGMTPARP10ALDH1A1 | |
| SCHEMBL8965572 | 0.70 | SYK (0.47) | GRM5TLR8TLR7SYKAURKB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007015877-A2 | INHIBITORS OF P38 KINASE AND METHODS OF TREATING INFLAMMATORY DISORDERS | KALYPSYS, INC. (US) | 2007-02-08 | — | — | WO | disclosed |
| WO-2007015877-A2 | INHIBITORS OF P38 KINASE AND METHODS OF TREATING INFLAMMATORY DISORDERS | KALYPSYS, INC. (US) | 2007-02-08 | — | — | WO | disclosed |