Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 3/20 | 0.61 |
| ▸ | PGR | P06401 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.46 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | KDM4A | O75164 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9834136 | 0.88 | NQO2 (0.51) | NQO2PGRSMN1; SMN2PDK2PDK4 | |
| SCHEMBL9831278 | 0.81 | NQO2 (0.61) | NQO2PGRSMN1; SMN2PDK2MAOA | |
| SCHEMBL14566623 | 0.80 | PDK2 (0.52) | PGRIDO1PDK2PDK4PDE3B | |
| SCHEMBL9120280 | 0.79 | GAA (0.53) | PGRSMN1; SMN2KMT2APOLBKDM4E | |
| SCHEMBL6620114 | 0.79 | CA12 (0.49) | NQO2SMN1; SMN2PDK2MAOAKMT2A | |
| SCHEMBL31714594 | 0.79 | ALDH1A1 (0.48) | NQO2SMN1; SMN2PDK2MAOAKMT2A | |
| SCHEMBL22803976 | 0.78 | HSPA9 (0.58) | KMT2AMEN1MAPTRAB9A | |
| SCHEMBL10532652 | 0.78 | PGR (0.54) | NQO2PGRSMN1; SMN2KMT2AMEN1 | |
| SCHEMBL9382451 | 0.78 | HDAC3 (0.65) | NQO2SMN1; SMN2MAOAKMT2AMEN1 | |
| SCHEMBL9376571 | 0.77 | CYP26A1 (0.52) | NQO2SMN1; SMN2KMT2AMEN1MAPT |
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-0268178-A1 | Pyrrolo-benzimidazoles, medicaments containing these compounds and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-05-25 | — | — | EP | disclosed |