Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.30 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | HRH1 | P35367 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11575209 | 0.88 | ALDH1A1 (0.37) | LMNACYP3A4NFKB1ALDH1A1 | |
| SCHEMBL6381596 | 0.76 | LMNA (0.37) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL6350861 | 0.76 | LMNA (0.37) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL17366581 | 0.76 | LMNA (0.37) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL21229181 | 0.75 | TSHR (0.37) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL6338975 | 0.74 | LMNA (0.40) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL1703156 | 0.74 | ALDH1A1 (0.36) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL9637665 | 0.74 | ALDH1A1 (0.43) | LMNATSHRCYP3A4NFKB1NPSR1 | |
| SCHEMBL4060151 | 0.72 | — | — | |
| SCHEMBL6342696 | 0.70 | ALDH1A1 (0.38) | LMNATSHRCYP3A4NFKB1NPSR1 |
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-4113444-A | HALONITRO ALCOHOLS | GULF RESEARCH & DEVELOPMENT CO. (US) | 1978-09-12 | — | — | US | disclosed |