Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 12/20 | 0.48 |
| ▸ | NCF1 | P14598 | 3/20 | 0.43 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.43 |
| ▸ | HTR3B | O95264 | 2/20 | 0.43 |
| ▸ | HTR3A | P46098 | 2/20 | 0.43 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.43 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27656471 | 0.85 | HTR6 (0.70) | HTR6NCF1HTR3EHTR3BHTR3A | |
| SCHEMBL5362969 | 0.84 | HTR6 (0.65) | HTR6NCF1HTR3EHTR3BHTR3A | |
| Tert-Butyl Formate SCHEMBL27656379 | 0.81 | HTR6 (0.42) | HTR6NCF1HTR3EHTR3BHTR3A | |
| Tert-Butyl Formate SCHEMBL27635294 | 0.80 | ADRB1 (0.50) | HTR6NCF1HTR3EHTR3BHTR3A | |
| Tert-Butyl Formate SCHEMBL27635279 | 0.80 | HTR6 (0.47) | HTR6NCF1HTR3EHTR3BHTR3A | |
| Tert-Butyl Formate SCHEMBL27588079 | 0.78 | HTR5A (0.41) | HTR6HTR3EHTR3BHTR3AHTR3D | |
| Tert-Butyl Formate SCHEMBL28761806 | 0.77 | NCF1 (0.44) | HTR6NCF1HTR3EHTR3BHTR3A | |
| Tert-Butyl Formate SCHEMBL27974539 | 0.76 | ADRB1 (0.47) | HTR6NCF1HTR3EHTR3BHTR3A | |
| Tert-Butyl Formate SCHEMBL27790951 | 0.76 | ADRB1 (0.47) | HTR6HTR3EHTR3BHTR3AHTR3D | |
| Tert-Butyl Formate SCHEMBL28256684 | 0.76 | ALDH1A1 (0.40) | HTR6HTR3EHTR3BHTR3AHTR3D |
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 |
|---|---|---|---|---|---|---|---|
| CN-100422181-C | [1,8] naphthyridin-2-ones and related compounds for the treatment of schizophrenia | WARNER LAMBERT CO (US) | 2008-10-01 | — | — | CN | disclosed |
| CN-1839134-A | [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia | WARNER LAMBERT CO (US) | 2006-09-27 | — | — | CN | disclosed |