Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CTSC | P53634 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4374565 | 1.00 | TSHR (0.41) | TSHRAOC3GAANPBWR1KMT2A | |
| SCHEMBL4369852 | 0.88 | TSHR (0.43) | TSHRAOC3GAANPBWR1KMT2A | |
| SCHEMBL7340967 | 0.83 | TSHR (0.44) | TSHRGAANPBWR1KMT2ANPSR1 | |
| SCHEMBL5871859 | 0.83 | TSHR (0.44) | TSHRGAANPBWR1KMT2ANPSR1 | |
| SCHEMBL5872219 | 0.83 | TSHR (0.44) | TSHRGAANPBWR1KMT2ANPSR1 | |
| SCHEMBL9328887 | 0.81 | AOC3 (0.45) | TSHRAOC3GAANPBWR1KMT2A | |
| SCHEMBL17275467 | 0.78 | TSHR (0.45) | TSHRAOC3GAANPBWR1KMT2A | |
| SCHEMBL28623788 | 0.78 | TSHR (0.45) | TSHRAOC3GAANPBWR1KMT2A | |
| SCHEMBL4543851 | 0.77 | LMNA (0.42) | AOC3KMT2AALDH1A1POLBLMNA | |
| SCHEMBL4365645 | 0.77 | LMNA (0.42) | AOC3KMT2AALDH1A1POLBLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009114633-A1 | PROCESS FOR THE PREPARATION OF (3S)-3-AMINO-N-CYCLOPROPYL-2-HYDROXYALKANAMIDE DERIVATIVES | VIROBAY, INC. (US) | 2009-09-17 | — | — | WO | disclosed |