Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 7/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9303256 | 0.89 | GAA (0.45) | HTTDRD3ALDH1A1LMNAMEN1 | |
| SCHEMBL9302880 | 0.87 | HTT (0.46) | HTTHSD17B10ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL9301733 | 0.82 | CYP11B2 (0.40) | HTTHSD17B10ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL9847719 | 0.82 | DRD3 (0.47) | HTTDRD3ALDH1A1LMNAMEN1 | |
| SCHEMBL9302130 | 0.76 | HTT (0.47) | HTTHSD17B10DRD3ALDH1A1SMN1; SMN2 | |
| SCHEMBL9303370 | 0.73 | ALDH1A1 (0.43) | HTTHSD17B10DRD3ALDH1A1SMN1; SMN2 | |
| SCHEMBL9302311 | 0.73 | CYP11B2 (0.44) | HTTHSD17B10DRD3ALDH1A1LMNA | |
| Hydrochloric Acid SCHEMBL9302957 | 0.72 | CYP11B1 (0.43) | HTTHSD17B10DRD3ALDH1A1LMNA | |
| SCHEMBL9301681 | 0.72 | HTT (0.42) | HTTSMN1; SMN2LMNAMAPTTHRB | |
| SCHEMBL9301127 | 0.70 | DRD3 (0.39) | DRD3ALDH1A1SMN1; SMN2LMNAMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0433648-A1 | Substituted pyrimidobenzimidazole derivatives | F. HOFFMANN-LA ROCHE AG (CH) | 1991-06-26 | — | — | EP | disclosed |