Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
| ▸ | KLKB1 | P03952 | 5/20 | 0.34 |
| ▸ | F11 | P03951 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23088269 | 1.00 | ALDH1A1 (0.40) | ALDH1A1NOTUMKMT2ATSHRPLAU | |
| SCHEMBL29792705 | 0.88 | NOTUM (0.39) | ALDH1A1NOTUMKMT2ATSHRKLKB1 | |
| SCHEMBL23088171 | 0.88 | NOTUM (0.39) | ALDH1A1NOTUMKMT2ATSHRKLKB1 | |
| SCHEMBL23088016 | 0.88 | NOTUM (0.42) | ALDH1A1NOTUMKMT2ATSHRKLKB1 | |
| SCHEMBL29792627 | 0.88 | NOTUM (0.42) | ALDH1A1NOTUMKMT2ATSHRKLKB1 | |
| SCHEMBL17221299 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KMT2ATSHRKLKB1F11 | |
| SCHEMBL29697621 | 0.84 | ALDH1A1 (0.55) | ALDH1A1KMT2ATSHRKLKB1F11 | |
| Hydrochloric Acid SCHEMBL21354812 | 0.83 | ALDH1A1 (0.53) | ALDH1A1KMT2ATSHRKLKB1F11 | |
| SCHEMBL23118864 | 0.79 | NOTUM (0.40) | ALDH1A1NOTUMKMT2ATSHRPLAU | |
| SCHEMBL23088219 | 0.76 | NOTUM (0.51) | ALDH1A1NOTUMKMT2APLAUF11 |
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-4031547-A1 | PLASMA KALLIKREIN INHIBITORS AND USES THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2022-07-27 | — | — | EP | disclosed |