Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | FGB | P02675 | 1/20 | 0.33 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9833693 | 0.88 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9835788 | 0.88 | MAPT (0.36) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9832994 | 0.86 | TP53 (0.34) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9834518 | 0.86 | ALDH1A1 (0.36) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9834982 | 0.86 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9834073 | 0.85 | ALDH1A1 (0.34) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9835008 | 0.85 | KDM4E (0.34) | ALDH1A1CYP1A2POLBMAPTMEN1 | |
| SCHEMBL9833426 | 0.84 | MAPT (0.34) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9834678 | 0.84 | TP53 (0.33) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 | |
| SCHEMBL9831490 | 0.84 | KDM4E (0.37) | ALDH1A1CYP1A2CYP2C19TP53SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0214592-B1 | PYRROLOBENZIMIDAZOLES, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THESE PRODUCTS | Roche Diagnostics GmbH (DE) | 1991-08-14 | — | — | EP | disclosed |
| US-4730003-A | Tricyclic compounds for treating heart and circulatory diseases | BOEHRINGER MANNHEIM GMBH (DE) | 1988-03-08 | — | — | US | disclosed |
| EP-0214592-A2 | Pyrrolobenzimidazoles, process for their preparation and medicaments containing these products | Roche Diagnostics GmbH (DE) | 1987-03-18 | — | — | EP | disclosed |