Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 5/20 | 0.46 |
| ▸ | CHRNA3 | P32297 | 5/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 5/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.43 |
| ▸ | CHRNB3 | Q05901 | 2/20 | 0.43 |
| ▸ | CHRNA2 | Q15822 | 2/20 | 0.40 |
| ▸ | PSIP1 | O75475 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | HTR3B | O95264 | 1/20 | 0.40 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8220685 | 1.00 | CHRNB4 (0.46) | CHRNB4CHRNA3CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL4795980 | 0.88 | CHRNB4 (0.48) | CHRNB4CHRNA3CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL4795682 | 0.88 | ROCK2 (0.40) | CHRNB4CHRNA3CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL4782463 | 0.85 | OPRM1 (0.44) | CHRNB4CHRNA3HDAC1 | |
| SCHEMBL8220552 | 0.81 | OPRD1 (0.46) | ALDH1A1KDM4ECYP3A4PSIP1BACE1 | |
| SCHEMBL4778904 | 0.81 | OPRD1 (0.46) | ALDH1A1KDM4ECYP3A4PSIP1BACE1 | |
| SCHEMBL4795928 | 0.81 | HTR1A (0.39) | ALDH1A1ACHEKDM4ECYP3A4RECQL | |
| SCHEMBL8222689 | 0.76 | CHRNB4 (0.48) | CHRNB4CHRNA3CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL1797148 | 0.75 | CHRNB4 (0.50) | CHRNB4CHRNA3 | |
| SCHEMBL1797151 | 0.75 | CHRNB4 (0.50) | CHRNB4CHRNA3 |
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-2008018639-A2 | GLYCINE TRANSPORTER INHIBITOR | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2008-02-14 | — | — | WO | disclosed |