Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10699756 | 0.97 | ALDH1A1 (0.45) | ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A | |
| SCHEMBL10698461 | 0.91 | KDM4E (0.40) | ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A | |
| SCHEMBL10697536 | 0.90 | MEN1 (0.35) | ALDH1A1KDM4ESMN1; SMN2HSD17B10HDAC1 | |
| SCHEMBL10699877 | 0.89 | MEN1 (0.41) | ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A | |
| SCHEMBL10697969 | 0.87 | MEN1 (0.35) | ALDH1A1KDM4ESMN1; SMN2HSD17B10HDAC1 | |
| SCHEMBL10695097 | 0.86 | PARP1 (0.40) | ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A | |
| SCHEMBL10699875 | 0.86 | MEN1 (0.40) | ALDH1A1KDM4ESMN1; SMN2MAPTRAB9A | |
| SCHEMBL10699164 | 0.83 | CYP11B1 (0.47) | ALDH1A1MAPTHPGDMEN1KMT2A | |
| SCHEMBL10707505 | 0.80 | CA12 (0.44) | ALDH1A1KDM4ERAB9ANPC1HSD17B10 | |
| SCHEMBL10699273 | 0.79 | DHODH (0.39) | ALDH1A1KDM4ERAB9ANPC1TP53 |
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 |