Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | WDR5 | P61964 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.47 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5000645 | 0.98 | LMNA (0.52) | LMNAALDH1A1MAPTWDR5MAPK1 | |
| SCHEMBL7536535 | 0.84 | MAPT (0.55) | ALDH1A1MAPTMAPK1HPGDTSHR | |
| SCHEMBL5003896 | 0.84 | KDM4E (0.64) | LMNAALDH1A1MAPTMAPK1L3MBTL1 | |
| SCHEMBL11423354 | 0.84 | MAPT (0.52) | LMNAALDH1A1MAPTWDR5MAPK1 | |
| SCHEMBL3453883 | 0.83 | S1PR4 (0.54) | ALDH1A1MAPTMAPK1HPGDTSHR | |
| SCHEMBL18949845 | 0.83 | LMNA (0.56) | LMNAALDH1A1MAPTWDR5MAPK1 | |
| SCHEMBL9143231 | 0.82 | KMT2A (0.56) | LMNAALDH1A1MAPTMAPK1L3MBTL1 | |
| SCHEMBL8918360 | 0.81 | MAPT (0.53) | ALDH1A1MAPTMAPK1HPGDTSHR | |
| Hydrochloric Acid SCHEMBL21595895 | 0.81 | S1PR4 (0.53) | MAPTMAPK1HPGDKDM4ES1PR4 | |
| Hydrochloric Acid SCHEMBL5004308 | 0.81 | DRD2 (0.46) | LMNAALDH1A1MAPK1TP53TSHR |
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-1611105-A1 | ISOQUINOLINE-5-SULFONIC ACID AMIDES AS INHIBITORS OF AKT (PROTEIN KINASE B) | ELI LILLY AND COMPANY (US) | 2006-01-04 | — | — | EP | disclosed |
| WO-2004094386-A1 | ISOQUINOLINE-5-SULFONIC ACID AMIDES AS INHIBITORS OF AKT (PROTEIN KINASE B) | ELI LILLY AND COMPANY (US) | 2004-11-04 | — | — | WO | disclosed |