Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR4 | Q13639 | 4/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | HTR3A | P46098 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL10627425 | 0.94 | KDM4E (0.53) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL1744462 | 0.88 | GAA (0.72) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL3373962 | 0.87 | KDM4E (0.69) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL28097982 | 0.86 | HSD17B2 (0.55) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL3615833 | 0.86 | KMT2A (0.54) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| Acetic Acid SCHEMBL5925542 | 0.84 | GAA (0.67) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL7853424 | 0.84 | GAA (0.76) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL16529387 | 0.83 | ALDH1A1 (0.51) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL24792080 | 0.82 | KDM4E (0.53) | HTR4CYP3A4CYP2D6HTR3ACYP1A2 | |
| SCHEMBL27248599 | 0.82 | HSD17B10 (0.47) | CYP3A4TSHRSMN1; SMN2GAAKDM4E |
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-2017192304-A1 | ARYLCARBOXAMIDES AND USES THEREOF | INCEPTION 1, INC. (US) | 2017-11-09 | — | — | WO | disclosed |