Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | PELI1 | Q96FA3 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.44 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.44 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9203397 | 0.85 | PELI1 (0.46) | BACE1MCL1PELI1ALOX5PTGS2 | |
| SCHEMBL3219906 | 0.84 | BACE1 (0.60) | BACE1MCL1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL19259769 | 0.78 | CHRM1 (0.42) | BACE1MCL1HSD17B10CHRM1MEN1 | |
| SCHEMBL12042134 | 0.78 | HSD17B1 (0.43) | MCL1ALDH1A1HPGDHSD17B10HSD17B1 | |
| SCHEMBL3791154 | 0.77 | ALDH1A1 (0.48) | BACE1ALDH1A1HPGDHSD17B10CHRM1 | |
| SCHEMBL27523260 | 0.77 | CHRM1 (0.41) | BACE1MCL1HSD17B10CHRM1MEN1 | |
| SCHEMBL5634704 | 0.77 | BACE1 (0.50) | BACE1MCL1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL14423572 | 0.76 | BACE1 (0.46) | BACE1MCL1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL8441433 | 0.76 | ALDH1A1 (0.58) | BACE1ALDH1A1HPGDHSD17B10BCL2L1 | |
| Hydrochloric Acid SCHEMBL9311238 | 0.76 | ALDH1A1 (0.47) | BACE1ALDH1A1HPGDHSD17B10CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106459149-A | Process for the liquid phase synthesis of h-inp-(d)bal-(d)trp-phe-apc-nh2, and pharmaceutically acceptable salts thereof | 莫图斯治疗公司 | 2017-02-22 | — | — | CN | disclosed |