Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CYP11B1 | P15538 | 3/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 3/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | SLC22A12 | Q96S37 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Quinoline SCHEMBL27783727 | 0.86 | NOTUM (0.71) | NOTUMALDH1A1HTTTSHRCYP11B1 | |
| SCHEMBL397539 | 0.83 | NOTUM (0.58) | NOTUMALDH1A1KDM4ETP53HSD17B10 | |
| SCHEMBL11962998 | 0.83 | NOTUM (0.58) | NOTUMALDH1A1KDM4ETP53HSD17B10 | |
| Quinoline SCHEMBL27742132 | 0.82 | NOTUM (0.48) | NOTUMALDH1A1KDM4ETP53HSD17B10 | |
| Quinoline SCHEMBL28069387 | 0.75 | PIK3CD (0.46) | ALDH1A1KDM4ETP53HSD17B10MAPT | |
| Quinoline SCHEMBL28837832 | 0.73 | ALDH1A1 (0.69) | ALDH1A1KDM4ETP53HSD17B10MAPT | |
| Quinoline SCHEMBL28169251 | 0.72 | ALDH1A1 (0.68) | ALDH1A1KDM4ETP53HSD17B10MAPT | |
| Quinoline SCHEMBL27635795 | 0.72 | ALDH1A1 (0.74) | ALDH1A1KDM4EMAPTCASP1HTT | |
| SCHEMBL31200457 | 0.71 | SLC22A12 (0.55) | NOTUMCYP11B1CYP11B2PARP1SLC22A12 | |
| SCHEMBL853076 | 0.71 | NOTUM (0.58) | NOTUMALDH1A1KDM4ETP53HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101193867-A | N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole libraries | OSI PHARM INC (US) | 2008-06-04 | — | — | CN | claimed |
| CN-101605758-A | Methods of treating hepatitis C | PTC THERAPEUTICS INC (US) | 2009-12-16 | — | — | CN | disclosed |
| CN-101193867-A | N-substituted benzimidazolyl c-Kit inhibitors and combinatorial benzimidazole libraries | OSI PHARM INC (US) | 2008-06-04 | — | — | CN | disclosed |