Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | LSS | P48449 | 4/20 | 0.36 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.36 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.36 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | EP300 | Q09472 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15632943 | 0.89 | IDO1 (0.40) | NPC1ALDH1A1RAB9ASMN1; SMN2LSS | |
| SCHEMBL3424759 | 0.86 | HRH4 (0.46) | ALDH1A1RAB9ALSSHRH4KDM4E | |
| SCHEMBL3425233 | 0.81 | HRH4 (0.42) | ALDH1A1HRH4KDM4ERECQLTDP1 | |
| SCHEMBL9084569 | 0.79 | HRH4 (0.33) | CXCR1CXCR2HRH4 | |
| SCHEMBL9083927 | 0.79 | HRH3 (0.38) | CXCR1CXCR2DGAT1HRH4HRH3 | |
| SCHEMBL17241798 | 0.79 | KDM1A (0.41) | HRH4HRH3KDM1AEP300 | |
| SCHEMBL1390734 | 0.78 | KDM1A (0.47) | NPC1ALDH1A1RAB9ASMN1; SMN2DGAT1 | |
| SCHEMBL9083528 | 0.78 | CXCR1 (0.36) | CXCR1CXCR2HRH4CYP3A4CYP2D6 | |
| SCHEMBL9084939 | 0.78 | BCHE (0.42) | CXCR1CXCR2DGAT1HRH4HRH3 | |
| SCHEMBL8969700 | 0.77 | KDM1A (0.41) | NPC1ALDH1A1RAB9ASMN1; SMN2DGAT1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5512207-A | Azaaromatic compounds, process for their preparation, and their use in liquid-crystalline mixtures | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-04-30 | — | — | US | disclosed |