Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.50 |
| ▸ | TMPRSS2 | O15393 | 1/20 | 0.50 |
| ▸ | F2 | P00734 | 1/20 | 0.50 |
| ▸ | F10 | P00742 | 1/20 | 0.50 |
| ▸ | PLG | P00747 | 1/20 | 0.50 |
| ▸ | F12 | P00748 | 1/20 | 0.50 |
| ▸ | PLAU | P00749 | 1/20 | 0.50 |
| ▸ | PLAT | P00750 | 1/20 | 0.50 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.50 |
| ▸ | HPN | P05981 | 1/20 | 0.50 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | SLC47A2 | Q86VL8 | 1/20 | 0.50 |
| ▸ | SLC47A1 | Q96FL8 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL76337 | 0.82 | MAPT (0.58) | CYP1A2MEN1KMT2AMAPTNPC1 | |
| SCHEMBL1201485 | 0.81 | CYP1A2 (0.48) | CYP1A2MEN1KMT2ASLC22A2TMPRSS2 | |
| SCHEMBL11260906 | 0.81 | CYP1A2 (0.48) | CYP1A2MEN1KMT2ASLC22A2TMPRSS2 | |
| SCHEMBL11455382 | 0.81 | CYP1A2 (0.48) | CYP1A2MEN1KMT2ASLC22A2TMPRSS2 | |
| SCHEMBL813523 | 0.79 | PRSS1 (0.42) | CYP1A2MEN1KMT2ASLC22A2TMPRSS2 | |
| SCHEMBL13611324 | 0.78 | PRSS1 (0.44) | CYP1A2CYP2D6MAPTNPC1RAB9A | |
| SCHEMBL10393516 | 0.76 | KMT2A (0.48) | CYP1A2MEN1KMT2ASLC22A2TMPRSS2 | |
| SCHEMBL11847874 | 0.76 | PRSS1 (0.43) | CYP1A2MEN1KMT2ACYP2D6SLC6A2 | |
| SCHEMBL49063 | 0.75 | CYP1A2 (0.52) | CYP1A2KMT2ARAB9AL3MBTL1TSHR | |
| SCHEMBL11158755 | 0.75 | CYP4Z1 (0.62) | CYP1A2CYP2D6TSHRCYP3A4GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |