Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 1/20 | 0.36 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 4/20 | 0.34 |
| ▸ | CBFB | Q13951 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 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 | |
|---|---|---|---|---|
| SCHEMBL12662570 | 0.91 | ALK (0.41) | ALKPARP1FGFR3NPC1RAB9A | |
| SCHEMBL12662565 | 0.91 | ALK (0.41) | ALKPARP1FGFR3NPC1RAB9A | |
| SCHEMBL12662408 | 0.83 | KCNMA1 (0.49) | PARP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL12662479 | 0.83 | PARP1 (0.41) | PARP1FGFR3NPC1RAB9AMEN1 | |
| SCHEMBL12662386 | 0.82 | PARP1 (0.52) | PARP1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL1889790 | 0.82 | PARP1 (0.44) | ALKPARP1FGFR3NPC1RAB9A | |
| SCHEMBL1889787 | 0.82 | PARP1 (0.44) | ALKPARP1FGFR3NPC1RAB9A | |
| SCHEMBL17787690 | 0.80 | ALK (0.41) | ALKFGFR3NPC1RAB9AMEN1 | |
| SCHEMBL12662584 | 0.80 | ALK (0.41) | ALKFGFR3NPC1RAB9AMEN1 | |
| SCHEMBL17787682 | 0.80 | ALK (0.41) | ALKFGFR3NPC1RAB9AMEN1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010003048-A1 | BENZIMIDAZOLES AND RELATED ANALOGS AS SIRTUIN MODULATORS | SIRTRIS PHARMACEUTICALS, INC. (US) | 2010-01-07 | — | — | WO | disclosed |