Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | GRM5 | P41594 | 2/20 | 0.46 |
| ▸ | PARP1 | P09874 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | BTK | Q06187 | 1/20 | 0.44 |
| ▸ | IKBKB | O14920 | 1/20 | 0.43 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL22584044 | 0.81 | NPSR1 (0.46) | NPSR1RXFP1GRM5PARP1KDM4E | |
| SCHEMBL3620548 | 0.79 | GRM5 (0.51) | NPSR1RXFP1GRM5PARP1KDM4E | |
| SCHEMBL29002505 | 0.78 | KDM4E (0.53) | PARP1KDM4ENPC1IKBKBDHODH | |
| SCHEMBL29455925 | 0.78 | GRM5 (0.50) | NPSR1RXFP1GRM5PARP1KDM4E | |
| SCHEMBL30422955 | 0.77 | THRB (0.44) | NPSR1RXFP1GRM5KDM4ETGFBR1 | |
| SCHEMBL18765294 | 0.77 | NPSR1 (0.48) | NPSR1RXFP1GRM5PARP1KDM4E | |
| SCHEMBL31395013 | 0.77 | NPSR1 (0.48) | NPSR1RXFP1GRM5PARP1KDM4E | |
| SCHEMBL5838653 | 0.77 | NPSR1 (0.51) | NPSR1RXFP1GRM5PARP1KDM4E | |
| SCHEMBL30761191 | 0.76 | IKBKB (0.49) | NPSR1RXFP1GRM5KDM4ENPC1 | |
| SCHEMBL16129055 | 0.76 | KDM4E (0.51) | KDM4ENPC1TGFBR1ALDH1A1PDE10A |
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-2181112-A1 | TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS | Merck Serono S.A. (CH) | 2010-05-05 | — | — | EP | disclosed |
| WO-2009027283-A1 | TRIAZOLOPYRIDINE COMPOUNDS AND THEIR USE AS ASK INHIBITORS | MERCK SERONO S.A. (CH) | 2009-03-05 | — | — | WO | disclosed |