Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | TP53 | P04637 | 4/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2005642 | 0.95 | GRM5 (0.39) | GRM5NPC1MAPTSMN1; SMN2LMNA | |
| SCHEMBL2001115 | 0.95 | GRM5 (0.41) | GRM5NPC1MAPTSMN1; SMN2LMNA | |
| SCHEMBL2009569 | 0.95 | GRM5 (0.39) | GRM5NPC1MAPTSMN1; SMN2LMNA | |
| SCHEMBL4564522 | 0.93 | NPC1 (0.38) | GRM5NPC1MAPTSMN1; SMN2LMNA | |
| SCHEMBL2005062 | 0.90 | EPHX2 (0.33) | NPC1MAPTSMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL2011254 | 0.89 | GRM5 (0.45) | GRM5NPC1MAPTSMN1; SMN2LMNA | |
| SCHEMBL2007450 | 0.87 | LMNA (0.38) | GRM5MAPTSMN1; SMN2LMNATP53 | |
| SCHEMBL2004941 | 0.86 | GRM5 (0.38) | GRM5NPC1MAPTSMN1; SMN2LMNA | |
| SCHEMBL2004659 | 0.86 | KDM4E (0.37) | NPC1MAPTLMNAHTTRAB9A | |
| SCHEMBL2003332 | 0.86 | SMN1; SMN2 (0.39) | NPC1MAPTSMN1; SMN2LMNAL3MBTL1 |
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 |