Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 8/20 | 0.43 |
| ▸ | MEN1 | O00255 | 6/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | NPY1R | P25929 | 1/20 | 0.42 |
| ▸ | NPY2R | P49146 | 1/20 | 0.42 |
| ▸ | NPBWR1 | P48145 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.39 |
| ▸ | CDK2 | P24941 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6805625 | 0.85 | PARP1 (0.64) | PARP1 | |
| SCHEMBL6806330 | 0.82 | MEN1 (0.60) | PARP1MAPTMEN1KMT2AALDH1A1 | |
| SCHEMBL6588249 | 0.75 | PARP1 (0.45) | PARP1HTR2AHTR6MAPTMEN1 | |
| SCHEMBL10067288 | 0.73 | GABRA1 (0.47) | PARP1HTR2AHTR6MAPTMEN1 | |
| SCHEMBL14023445 | 0.70 | MAPT (0.46) | PARP1HTR2AHTR6MAPTMEN1 | |
| SCHEMBL17366642 | 0.70 | MEN1 (0.46) | PARP1HTR2AHTR6MAPTMEN1 | |
| SCHEMBL14023716 | 0.70 | MEN1 (0.46) | PARP1HTR2AHTR6MAPTMEN1 | |
| SCHEMBL871830 | 0.69 | PARP1 (0.58) | PARP1HSD17B10FLT3CDK5MAPK1 | |
| SCHEMBL29696369 | 0.68 | NPC1 (0.53) | PARP1NPBWR1RAB9ANPC1 | |
| SCHEMBL8698017 | 0.67 | CCNE1 (0.44) | PARP1MAPTMEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6696437-B1 | Heterocyclically substituted benzimidazoles, the production and application thereof | ABBOTT GMBH & CO. KG (DE) | 2004-02-24 | — | — | US | disclosed |