Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 4/20 | 0.46 |
| ▸ | DRD4 | P21917 | 4/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.45 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HTR1A | P08908 | 2/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.44 |
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 SCHEMBL5004554 | 0.98 | KDM4E (0.55) | KDM4EMEN1KMT2AHTR7L3MBTL1 | |
| SCHEMBL25471321 | 0.83 | HTR1B (0.62) | KDM4EMEN1KMT2AHTR7L3MBTL1 | |
| SCHEMBL12804709 | 0.83 | HTR1D (0.62) | KDM4EMEN1KMT2AHTR7L3MBTL1 | |
| Hydrochloric Acid SCHEMBL8053976 | 0.82 | DRD4 (0.69) | KDM4EMEN1KMT2ADRD2DRD4 | |
| SCHEMBL1458209 | 0.81 | KDM4E (0.68) | KDM4EMEN1KMT2AHTR7L3MBTL1 | |
| SCHEMBL5004452 | 0.81 | ALDH1A1 (0.52) | KDM4EMEN1KMT2AL3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL26624007 | 0.80 | KDM4E (0.72) | KDM4EMEN1KMT2AHTR7L3MBTL1 | |
| SCHEMBL5739036 | 0.79 | DRD2 (0.71) | KDM4EMEN1KMT2AL3MBTL1ALDH1A1 | |
| SCHEMBL701534 | 0.79 | HTR7 (0.64) | KDM4EMEN1KMT2AHTR7L3MBTL1 | |
| SCHEMBL2344935 | 0.79 | HTR7 (0.64) | KDM4EMEN1KMT2AHTR7L3MBTL1 |
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 |