Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.41 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | UBE2M | P61081 | 2/20 | 0.39 |
| ▸ | DCUN1D1 | Q96GG9 | 2/20 | 0.39 |
| ▸ | METAP2 | P50579 | 1/20 | 0.39 |
| ▸ | YAP1 | P46937 | 1/20 | 0.39 |
| ▸ | TEAD4 | Q15561 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL841382 | 1.00 | TP53 (0.47) | TP53MAPTSMN1; SMN2GPR88PTGES | |
| SCHEMBL842349 | 0.90 | TP53 (0.49) | TP53MAPTSMN1; SMN2PTGESYAP1 | |
| SCHEMBL4324743 | 0.90 | TP53 (0.49) | TP53MAPTSMN1; SMN2PTGESYAP1 | |
| SCHEMBL329042 | 0.89 | TP53 (0.44) | TP53MAPTSMN1; SMN2GPR88PTGES | |
| SCHEMBL842533 | 0.83 | TP53 (0.46) | TP53MAPTSMN1; SMN2GPR88UBE2M | |
| SCHEMBL842534 | 0.83 | TP53 (0.46) | TP53MAPTSMN1; SMN2GPR88UBE2M | |
| SCHEMBL842299 | 0.82 | TP53 (0.44) | TP53MAPTSMN1; SMN2PTGESMETAP2 | |
| SCHEMBL4543851 | 0.80 | LMNA (0.42) | MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL4365645 | 0.80 | LMNA (0.42) | MEN1KMT2AALDH1A1LMNA | |
| SCHEMBL1445825 | 0.80 | TP53 (0.43) | TP53MAPTSMN1; SMN2GPR88PTGES |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009114633-A1 | PROCESS FOR THE PREPARATION OF (3S)-3-AMINO-N-CYCLOPROPYL-2-HYDROXYALKANAMIDE DERIVATIVES | VIROBAY, INC. (US) | 2009-09-17 | — | — | WO | claimed |
| WO-2009152474-A2 | PROCESS FOR THE PREPARATION OF (3S)-3-AMINO-N-CYCLOPROPYL-2-HYDROXYALKANAMIDE DERIVATIVES | VIROBAY, INC. (US) | 2009-12-17 | — | — | WO | disclosed |
| WO-2009114633-A1 | PROCESS FOR THE PREPARATION OF (3S)-3-AMINO-N-CYCLOPROPYL-2-HYDROXYALKANAMIDE DERIVATIVES | VIROBAY, INC. (US) | 2009-09-17 | — | — | WO | disclosed |