Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | EBP | Q15125 | 1/20 | 0.37 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20169995 | 0.93 | OPRL1 (0.38) | SIGMAR1SLC6A2SLC6A4SLC6A3OPRL1 | |
| SCHEMBL20103409 | 0.82 | ESR1 (0.39) | SLC6A2SLC6A4SLC6A3OPRL1HTR6 | |
| SCHEMBL10829892 | 0.81 | SIGMAR1 (0.48) | SIGMAR1TMEM97EBPNUDT1BACE1 | |
| SCHEMBL765783 | 0.79 | BACE1 (0.41) | NUDT1BACE1OPRL1TRPA1HTR6 | |
| SCHEMBL15026744 | 0.79 | BACE1 (0.59) | NUDT1BACE1TRPA1DRD2DRD1 | |
| SCHEMBL20975790 | 0.78 | OPRL1 (0.39) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL27278204 | 0.76 | PTGDR2 (0.42) | SIGMAR1TMEM97EBPSLC6A2SLC6A4 | |
| SCHEMBL8022076 | 0.75 | NUDT1 (0.64) | NUDT1BACE1TRPA1DRD2DRD1 | |
| SCHEMBL14297935 | 0.75 | BACE1 (0.44) | NUDT1BACE1OPRL1TRPA1HTR6 | |
| SCHEMBL16962250 | 0.74 | SLC6A2 (0.49) | NUDT1BACE1SLC6A2SLC6A4SLC6A3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014153037-A1 | SUBSTITUTED TRIAZOLOPYRIDINES AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2014-09-25 | — | — | WO | disclosed |
| WO-2014144545-A2 | SUBSTITUTED BENZOXAZOLES AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2014-09-18 | — | — | WO | disclosed |
| WO-2014008458-A2 | N-SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2014-01-09 | — | — | WO | disclosed |