Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 6/20 | 0.41 |
| ▸ | SLC9A1 | P19634 | 5/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | G6PD | P11413 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18272006 | 0.93 | SLC9A1 (0.38) | NOTUMSLC9A1KCNH2HTR2CCYP3A4 | |
| SCHEMBL23099892 | 0.85 | NOTUM (0.45) | NOTUMSLC9A1KCNH2HTR2CADRA1D | |
| SCHEMBL30573139 | 0.84 | ALDH1A1 (0.40) | CYP3A4CYP2C9CYP2C19KDM4EALDH1A1 | |
| SCHEMBL18272019 | 0.84 | ALDH1A1 (0.40) | CYP3A4CYP2C9CYP2C19KDM4EALDH1A1 | |
| SCHEMBL18272080 | 0.83 | NOTUM (0.39) | NOTUMSLC9A1KCNH2HTR2CKDM4E | |
| SCHEMBL13878821 | 0.79 | NOTUM (0.41) | NOTUMSLC9A1KCNH2HTR2C | |
| SCHEMBL16736778 | 0.76 | KDM4E (0.37) | NOTUMCYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL16736680 | 0.75 | EPHX1 (0.32) | KCNH2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL12572591 | 0.74 | ALOX15 (0.48) | CYP3A4CYP2C9CYP2C19KDM4EALDH1A1 | |
| SCHEMBL17864634 | 0.74 | ALDH1A1 (0.48) | CYP3A4CYP2C9CYP2C19KDM4EALDH1A1 |
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-2016190871-A1 | 2,5-DIALKYL-4-H/HALO/ETHER-PHENOL COMPOUNDS | TANSNA THERAPEUTICS, INC. (US) | 2016-12-01 | — | — | WO | disclosed |