Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 9/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CTSD | P07339 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2002872 | 0.96 | PLA2G2A (0.49) | PLA2G2ANPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2004994 | 0.90 | MAPT (0.44) | PLA2G2AALDH1A1TSHRPKMKMT2A | |
| SCHEMBL2002804 | 0.88 | NPC1 (0.45) | PLA2G2ANPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2003492 | 0.88 | PLA2G2A (0.43) | PLA2G2ANPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2003055 | 0.87 | ALDH1A1 (0.52) | PLA2G2AALDH1A1TSHRPLA2G1BHTT | |
| SCHEMBL2002769 | 0.85 | PLA2G2A (0.52) | PLA2G2AALDH1A1TSHRPLA2G1BHTT | |
| SCHEMBL2007631 | 0.85 | ALDH1A1 (0.49) | PLA2G2AALDH1A1TSHRPLA2G1BPKM | |
| SCHEMBL2010602 | 0.85 | ALDH1A1 (0.49) | PLA2G2AALDH1A1TSHRPLA2G1BPKM | |
| SCHEMBL2002545 | 0.85 | ALDH1A1 (0.49) | PLA2G2AALDH1A1TSHRPLA2G1BHTT | |
| SCHEMBL1998107 | 0.84 | PLA2G2A (0.57) | PLA2G2AALDH1A1TSHRPLA2G1BHTT |
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 |