Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.33 |
| ▸ | PREP | P48147 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.31 |
| ▸ | GABRA6 | Q16445 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GABRP | O00591 | 1/20 | 0.31 |
| ▸ | GABRD | O14764 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1320587 | 0.76 | ELANE (0.32) | ADRA1AADRA1BGABRA1GABRG2GABRB3 | |
| SCHEMBL18703898 | 0.74 | ADRA1A (0.34) | ADRA1AADRA1BCYP2C9CYP2C19NPSR1 | |
| SCHEMBL15567828 | 0.73 | RAB9A (0.38) | ADRA1AADRA1BCYP2C9CYP2C19NPSR1 | |
| SCHEMBL1566864 | 0.73 | CA12 (0.38) | ADRA1AADRA1BGABRA1GABRG2GABRB3 | |
| SCHEMBL163017 | 0.73 | CA12 (0.35) | ADRA1AADRA1BGABRA1GABRG2GABRB3 | |
| SCHEMBL8562952 | 0.71 | ALDH1A1 (0.38) | ADRA1AADRA1BGABRA1GABRG2GABRB3 | |
| SCHEMBL624330 | 0.69 | RAB9A (0.33) | ADRA1AADRA1BGABRA1GABRG2GABRB3 | |
| SCHEMBL28587355 | 0.69 | ALDH1A1 (0.36) | ADRA1AADRA1BNPSR1ALDH1A1AR | |
| SCHEMBL28816343 | 0.69 | ALDH1A1 (0.45) | ADRA1AADRA1BLMNAALDH1A1RAB9A | |
| SCHEMBL3801958 | 0.67 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2MAPTALOX15HSD17B10 |
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-1660443-A2 | CYCLIC AMINE BACE-1 INHIBITORS HAVING A BENZAMIDE SUBSTITUENT | SCHERING CORPORATION (US) | 2006-05-31 | — | — | EP | disclosed |
| WO-2005016876-A2 | CYCLIC AMINE BACE-1 INHIBITORS HAVING A BENZAMIDE SUBSTITUENT | SCHERING CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |