Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | GFER | P55789 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29495959 | 1.00 | ALDH1A1 (0.45) | ALDH1A1HPGDGFERMEN1KMT2A | |
| SCHEMBL11699938 | 0.80 | ALDH1A1 (0.50) | ALDH1A1HPGDGFERMEN1KMT2A | |
| SCHEMBL3820980 | 0.76 | ALDH1A1 (0.47) | ALDH1A1HPGDGFERMEN1KMT2A | |
| SCHEMBL31419288 | 0.72 | ALDH1A1 (0.44) | ALDH1A1HPGDGFERMEN1KMT2A | |
| SCHEMBL8509189 | 0.70 | HTT (0.46) | ALDH1A1RAB9ANPC1HTTNPSR1 | |
| SCHEMBL29495799 | 0.70 | SIGMAR1 (0.50) | ALDH1A1HPGDGFERL3MBTL1CTSL | |
| SCHEMBL10498731 | 0.69 | ALDH1A1 (0.50) | ALDH1A1HPGDGFERMEN1KMT2A | |
| SCHEMBL372242 | 0.69 | TERT (0.54) | ALDH1A1RAB9ANPC1HTTNPSR1 | |
| SCHEMBL29463702 | 0.69 | TERT (0.54) | ALDH1A1RAB9ANPC1HTTNPSR1 | |
| SCHEMBL5441435 | 0.69 | HTT (0.49) | ALDH1A1RAB9ANPC1HTTNPSR1 |
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-2022072975-A1 | COMPOSITIONS AND METHODS OF TREATMENT FOR SARS-COV-2 THROUGH PAPAIN PROTEASE INHIBITION | UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) | 2022-04-07 | — | — | WO | disclosed |