Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | CHEK2 | O96017 | 8/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 3/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6806553 | 0.84 | PARP1 (0.59) | SMN1; SMN2LMNAMAPTTSHRMAPK1 | |
| SCHEMBL6805596 | 0.74 | PARP1 (0.57) | CHEK2PARP1PARP2 | |
| SCHEMBL6805066 | 0.74 | PARP1 (0.50) | SMN1; SMN2LMNAMAPTTSHRMAPK1 | |
| SCHEMBL6589391 | 0.74 | LMNA (0.46) | SMN1; SMN2LMNAMAPTTSHRMAPK1 | |
| SCHEMBL6807085 | 0.74 | NR3C2 (0.43) | CHEK2PARP1PARP2PARP3KMT2A | |
| SCHEMBL6807111 | 0.71 | PARP1 (0.46) | CHEK2PARP1PARP2PARP3KMT2A | |
| SCHEMBL6810628 | 0.71 | PARP1 (0.52) | PARP1PARP2PARP3 | |
| SCHEMBL6810614 | 0.70 | MAP4K4 (0.52) | MAPTCHEK2PARP1PARP2PARP3 | |
| SCHEMBL6805843 | 0.69 | PARP1 (0.56) | CHEK2PARP1 | |
| SCHEMBL6806912 | 0.69 | GRM2 (0.44) | PARP1PARP2PARP3KMT2A |
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 |