Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 6/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | AMPD2 | Q01433 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27952439 | 0.89 | CYP2D6 (0.46) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL15665132 | 0.89 | CYP2D6 (0.46) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL15923278 | 0.89 | CYP2D6 (0.46) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL14234878 | 0.87 | CYP2D6 (0.50) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL25000116 | 0.84 | CYP2D6 (0.48) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL15924822 | 0.81 | CYP2D6 (0.43) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL16589467 | 0.78 | LMNA (0.43) | MEN1KMT2ATSHRALDH1A1LMNA | |
| SCHEMBL6184097 | 0.78 | FFAR1 (0.51) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL6184100 | 0.78 | FFAR1 (0.51) | CYP2D6MEN1KMT2ATSHRCYP3A4 | |
| SCHEMBL8936204 | 0.78 | OPRL1 (0.46) | CYP2D6MEN1KMT2ATSHRCYP3A4 |
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-2247600-A2 | BENZOXAZOLE CARBOXAMIDE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) | Lead Therapeutics, Inc. (US) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009099736-A2 | BENZOXAZOLE CARBOXAMIDE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) | LEAD THERAPEUTICS, INC. (US) | 2009-08-13 | — | — | WO | disclosed |