Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.43 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 2/20 | 0.43 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 2/20 | 0.43 |
| ▸ | DRD3 | P35462 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 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 | |
|---|---|---|---|---|
| SCHEMBL5746101 | 0.98 | TDP1 (0.49) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5748212 | 0.96 | TSHR (0.50) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5748430 | 0.94 | BCHE (0.52) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5746363 | 0.92 | TDP1 (0.53) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5774079 | 0.91 | HRH3 (0.53) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5747882 | 0.85 | ABCG2 (0.54) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5747157 | 0.83 | ABCG2 (0.54) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5747873 | 0.82 | ABCG2 (0.53) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5747013 | 0.80 | BCHE (0.54) | BCHECHRNB2ACHECHRNA7CHRNA4 | |
| SCHEMBL5749626 | 0.78 | HTR1B (0.51) | BCHECHRNB2ACHECHRNA7CHRNA4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1711463-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2006-10-18 | — | — | EP | claimed |
| WO-2005077899-A2 | AMINO-SUBSTITUTED TRICYCLIC DERIVATIVES AND METHODS OF USE | ABBOTT LABORATORIES (US) | 2005-08-25 | — | — | WO | claimed |