Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | KCNMA1 | Q12791 | 1/20 | 0.46 |
| ▸ | IDH2 | P48735 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | BRPF1 | P55201 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19977001 | 0.90 | KMT2A (0.47) | ALDH1A1KDM4ENPSR1HPGDTSHR | |
| SCHEMBL19977130 | 0.89 | L3MBTL1 (0.44) | ALDH1A1KDM4EL3MBTL1ATMBACE1 | |
| SCHEMBL19976964 | 0.88 | L3MBTL1 (0.58) | ALDH1A1NPSR1TSHRPOLBHSD17B10 | |
| SCHEMBL16993937 | 0.86 | CTSV (0.51) | ALDH1A1KDM4ENPSR1HPGDTSHR | |
| SCHEMBL19976968 | 0.81 | KCNMA1 (0.57) | ALDH1A1KDM4ENPSR1HPGDPOLB | |
| SCHEMBL19977012 | 0.80 | ALDH1A1 (0.46) | ALDH1A1KDM4ENPSR1HPGDTSHR | |
| SCHEMBL19977068 | 0.78 | BACE1 (0.57) | ALDH1A1KDM4ENPSR1HPGDTSHR | |
| SCHEMBL19977110 | 0.78 | BACE1 (0.48) | ALDH1A1NPSR1HPGDPOLBBACE1 | |
| SCHEMBL19977098 | 0.77 | KDM4E (0.51) | ALDH1A1KDM4ENPSR1HPGDTSHR | |
| SCHEMBL19977129 | 0.77 | ALDH1A1 (0.57) | ALDH1A1NPSR1TSHRPOLBHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3102193-B1 | ANTIBACTERIAL AGENTS: N(ALPHA)-AROYL-N-ARYL-PHENYLALANINAMIDES | UNIV RUTGERS (US) | 2023-01-11 | — | — | EP | disclosed |
| US-9919998-B2 | Antibacterial agents: Nα-aroyl-N-aryl-phenylalaninamides | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2018-03-20 | — | — | US | disclosed |