Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | SRR | Q9GZT4 | 2/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
| ▸ | ALPI | P09923 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | XIAP | P98170 | 1/20 | 0.46 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7292748 | 1.00 | PKM (0.54) | PKMCYP1A2SMN1; SMN2CYP2D6NPSR1 | |
| SCHEMBL5622799 | 0.86 | NPC1 (0.53) | CYP1A2NPC1RAB9ALMNASLC6A2 | |
| SCHEMBL16137501 | 0.84 | ALDH1A1 (0.56) | PKMCYP1A2NPC1RAB9ALMNA | |
| SCHEMBL15247513 | 0.84 | ALDH1A1 (0.56) | PKMCYP1A2NPC1RAB9ALMNA | |
| SCHEMBL10886546 | 0.84 | ALDH1A1 (0.56) | PKMCYP1A2NPC1RAB9ALMNA | |
| SCHEMBL24073103 | 0.84 | NPC1 (0.51) | CYP1A2NPC1RAB9ALMNASRR | |
| SCHEMBL9049029 | 0.83 | CYP1A2 (0.56) | PKMCYP1A2SMN1; SMN2CYP2D6NPSR1 | |
| SCHEMBL7260000 | 0.83 | CYP3A4 (0.50) | CYP1A2NPC1RAB9ALMNAALDH1A1 | |
| SCHEMBL7292741 | 0.83 | NPC1 (0.50) | CYP1A2NPC1RAB9ALMNASRR | |
| SCHEMBL8926076 | 0.81 | NPC1 (0.49) | CYP1A2NPC1RAB9ALMNASRR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021158899-A1 | ELONGATION FACTOR 1-ALPHA INHIBITORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-08-12 | — | — | WO | disclosed |
| WO-2021011723-A1 | ANTI-OSTEOARTHRITIS HYDANTOIN COMPOUNDS AND RELATED COMPOSITIONS AND METHODS | AVIDENCE THERAPEUTICS, INC. (US) | 2021-01-21 | — | — | WO | disclosed |