Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP4Z1 | Q86W10 | 1/20 | 0.45 |
| ▸ | CYP4F11 | Q9HBI6 | 1/20 | 0.45 |
| ▸ | CYP4F12 | Q9HCS2 | 1/20 | 0.45 |
| ▸ | TUBB4A | P04350 | 3/20 | 0.44 |
| ▸ | TUBB | P07437 | 3/20 | 0.44 |
| ▸ | TUBA3C | P0DPH7 | 3/20 | 0.44 |
| ▸ | TUBA1B | P68363 | 3/20 | 0.44 |
| ▸ | TUBA4A | P68366 | 3/20 | 0.44 |
| ▸ | TUBB4B | P68371 | 3/20 | 0.44 |
| ▸ | TUBB3 | Q13509 | 3/20 | 0.44 |
| ▸ | TUBB2A | Q13885 | 3/20 | 0.44 |
| ▸ | TUBB8 | Q3ZCM7 | 3/20 | 0.44 |
| ▸ | TUBA3E | Q6PEY2 | 3/20 | 0.44 |
| ▸ | TUBA1A | Q71U36 | 3/20 | 0.44 |
| ▸ | TUBA1C | Q9BQE3 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28316149 | 0.88 | SKP2 (0.47) | CYP1A2CYP2D6CYP2C9CYP2C19CYP3A4 | |
| SCHEMBL27554750 | 0.85 | TUBB4A (0.44) | CYP1A2CYP2D6CYP2C9CYP2C19TUBB4A | |
| SCHEMBL3916081 | 0.83 | ALDH1A1 (0.48) | CYP1A2CYP2C9CYP2C19ESR1AKR1B10 | |
| SCHEMBL3916083 | 0.83 | ALDH1A1 (0.48) | CYP1A2CYP2C9CYP2C19ESR1AKR1B10 | |
| SCHEMBL13775062 | 0.81 | HDAC8 (0.51) | CYP1A2CYP2C9CYP2C19ESR1ALDH1A1 | |
| SCHEMBL8055161 | 0.79 | CA12 (0.58) | LMNAAKR1B10AKR1B1ALDH1A1MEN1 | |
| SCHEMBL28333101 | 0.78 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19AKR1B10AKR1B1 | |
| SCHEMBL21611781 | 0.78 | ALDH1A1 (0.46) | CYP1A2CYP2C9CYP2C19AKR1B10AKR1B1 | |
| SCHEMBL5542490 | 0.76 | MAPT (0.53) | CYP1A2CYP2C9CYP2C19LMNAESR1 | |
| SCHEMBL6505316 | 0.76 | MAPT (0.53) | CYP1A2CYP2C9CYP2C19LMNAESR1 |
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-2018104766-A1 | 3-(2,3-DIHYDRO-1H-INDEN-5-YL)PROPANOIC ACID DERIVATIVES AND THEIR USE AS NRF2 REGULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-06-14 | — | — | WO | disclosed |