Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | PSMB5 | P28074 | 2/20 | 0.37 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2001925 | 0.93 | LMNA (0.41) | NPC1SMN1; SMN2RAB9ATP53LMNA | |
| SCHEMBL2001583 | 0.91 | LMNA (0.40) | S1PR1NPC1SMN1; SMN2RAB9ATP53 | |
| SCHEMBL2004059 | 0.91 | S1PR1 (0.46) | S1PR1NPC1SMN1; SMN2RAB9ATP53 | |
| SCHEMBL2002951 | 0.91 | S1PR1 (0.41) | S1PR1NPC1SMN1; SMN2RAB9ATP53 | |
| SCHEMBL2002145 | 0.91 | LMNA (0.43) | NPC1SMN1; SMN2RAB9ATP53LMNA | |
| SCHEMBL2003553 | 0.89 | GSK3B (0.42) | NPC1SMN1; SMN2RAB9ATP53NFKB1 | |
| SCHEMBL2005780 | 0.88 | LMNA (0.41) | NPC1SMN1; SMN2RAB9ATP53LMNA | |
| SCHEMBL2004267 | 0.88 | S1PR1 (0.42) | S1PR1NPC1SMN1; SMN2RAB9ATP53 | |
| SCHEMBL2006961 | 0.88 | LMNA (0.40) | NPC1SMN1; SMN2RAB9ALMNAL3MBTL1 | |
| SCHEMBL2004501 | 0.87 | LMNA (0.43) | SMN1; SMN2TP53LMNAL3MBTL1TSHR |
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 |