Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A1 | P43005 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SI | P14410 | 1/20 | 0.41 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.38 |
| ▸ | GRM8 | O00222 | 1/20 | 0.37 |
| ▸ | GRM6 | O15303 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.37 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.37 |
| ▸ | GSR | P00390 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27432122 | 1.00 | SLC1A1 (0.55) | SLC1A1TSHRLMNAKDM4EMGAM | |
| SCHEMBL3160361 | 0.88 | TSHR (0.54) | SLC1A1TSHRLMNAKDM4EMGAM | |
| Hydrochloric Acid SCHEMBL3160355 | 0.86 | TSHR (0.52) | SLC1A1TSHRLMNAKDM4EMGAM | |
| SCHEMBL131049 | 0.83 | SLC1A1 (0.55) | SLC1A1TSHRLMNAKDM4EMGAM | |
| SCHEMBL142983 | 0.83 | SLC1A1 (0.70) | SLC1A1TSHRLMNAKDM4EKMT2A | |
| SCHEMBL1983229 | 0.83 | SLC1A1 (0.70) | SLC1A1TSHRLMNAKDM4EKMT2A | |
| SCHEMBL131050 | 0.83 | SLC1A1 (0.55) | SLC1A1TSHRLMNAKDM4EMGAM | |
| SCHEMBL6753794 | 0.83 | SLC1A1 (0.55) | SLC1A1TSHRLMNAKDM4EKMT2A | |
| SCHEMBL1666146 | 0.83 | SLC1A1 (0.70) | SLC1A1TSHRLMNAKDM4EKMT2A | |
| SCHEMBL2610089 | 0.83 | SLC1A1 (0.38) | SLC1A1MGAMGAASIMGAM2 |
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-3658545-B1 | METHOD FOR PREPARING 3-[(3S)-7-BROMO-2-OXO-5-(PYRIDIN-2-YL)-2,3-DIHYDRO-1H-[1,4]-BENZODIAZEPIN-3-YL]PROPIONIC ACID METHYL ESTER, AND COMPOUNDS USEFUL IN THAT METHOD | MOEHS IBERICA SL (ES) | 2021-08-11 | — | — | EP | disclosed |