Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 2/20 | 0.56 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.52 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.52 |
| ▸ | EGFR | P00533 | 2/20 | 0.49 |
| ▸ | TPH1 | P17752 | 1/20 | 0.49 |
| ▸ | SRC | P12931 | 1/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | ALPI | P09923 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | XIAP | P98170 | 1/20 | 0.47 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28084151 | 1.00 | CTSC (0.56) | CTSCSLC1A3SLC1A2EGFRTPH1 | |
| Hydrochloric Acid SCHEMBL14486038 | 0.99 | CTSC (0.54) | CTSCSLC1A3SLC1A2EGFRTPH1 | |
| Hydrochloric Acid SCHEMBL14486037 | 0.99 | CTSC (0.54) | CTSCSLC1A3SLC1A2EGFRTPH1 | |
| SCHEMBL15307625 | 0.89 | LOXL2 (0.57) | CTSCSLC1A3SLC1A2TPH1 | |
| SCHEMBL7413310 | 0.87 | ALPI (0.61) | CTSCEGFRSRCMMP8ALPI | |
| SCHEMBL3114367 | 0.87 | ALPI (0.61) | CTSCEGFRSRCMMP8ALPI | |
| SCHEMBL17366111 | 0.87 | MMP8 (0.51) | CTSCSLC1A3SLC1A2EGFRSRC | |
| Hydrochloric Acid SCHEMBL3385081 | 0.85 | MMP8 (0.59) | CTSCEGFRSRCMMP8ALPI | |
| Hydrochloric Acid SCHEMBL27492563 | 0.85 | MMP8 (0.59) | CTSCEGFRSRCMMP8ALPI | |
| SCHEMBL6440952 | 0.85 | MMP8 (0.61) | SLC1A3SLC1A2MMP8MAOA |
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 |
|---|---|---|---|---|---|---|---|
| CN-103687846-B | Benzyl amine derivative as inhibitors of plasma kallikrein | 卡尔维斯塔制药有限公司 | 2016-06-22 | — | — | CN | disclosed |