Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 10/20 | 0.37 |
| ▸ | RAB9A | P51151 | 9/20 | 0.37 |
| ▸ | AR | P10275 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 9/20 | 0.35 |
| ▸ | MAPT | P10636 | 6/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 5/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.35 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1999445 | 0.95 | GRM5 (0.41) | GRM5NPC1RAB9AARSMN1; SMN2 | |
| SCHEMBL2005642 | 0.92 | GRM5 (0.39) | GRM5NPC1RAB9AARSMN1; SMN2 | |
| SCHEMBL2001115 | 0.92 | GRM5 (0.41) | GRM5NPC1RAB9AARSMN1; SMN2 | |
| SCHEMBL4564522 | 0.91 | NPC1 (0.38) | GRM5NPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL2005516 | 0.91 | FAAH (0.33) | NPC1SMN1; SMN2LMNATP53MEN1 | |
| SCHEMBL2001286 | 0.90 | GRM5 (0.41) | GRM5NPC1RAB9AARSMN1; SMN2 | |
| SCHEMBL2003201 | 0.90 | GRM5 (0.41) | GRM5NPC1RAB9AARSMN1; SMN2 | |
| SCHEMBL2001936 | 0.87 | OPRK1 (0.36) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL2006492 | 0.87 | GRM5 (0.35) | GRM5NPC1SMN1; SMN2MAPTLMNA | |
| SCHEMBL2007825 | 0.87 | TP53 (0.43) | NPC1RAB9ASMN1; SMN2MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-7960544-B2 | Useful indole compounds | IRONWOOD PHARMACEUTICALS, INC. (US) | 2011-06-14 | — | — | US | disclosed |