Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 4/20 | 0.35 |
| ▸ | CES1 | P23141 | 4/20 | 0.35 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2008404 | 0.95 | L3MBTL1 (0.39) | KDM4EOPRK1TSHRLMNAALDH1A1 | |
| SCHEMBL2003477 | 0.95 | LMNA (0.40) | KDM4EOPRK1TSHRLMNAALDH1A1 | |
| SCHEMBL2001936 | 0.95 | OPRK1 (0.36) | KDM4EOPRK1TSHRLMNAALDH1A1 | |
| SCHEMBL2003372 | 0.93 | PLA2G2A (0.38) | KDM4EOPRK1MAPTCYP1A2CYP2D6 | |
| SCHEMBL2004340 | 0.92 | F2RL3 (0.37) | KDM4EOPRK1LMNAMAPTFAAH | |
| SCHEMBL2004657 | 0.91 | FAAH (0.38) | KDM4EOPRK1TSHRMAPTALOX12 | |
| SCHEMBL2003824 | 0.90 | LMNA (0.33) | TSHRLMNAALDH1A1MAPTALOX12 | |
| SCHEMBL2003934 | 0.89 | KDM4E (0.39) | KDM4EOPRK1TSHRLMNAALDH1A1 | |
| SCHEMBL2004704 | 0.88 | LMNA (0.38) | KDM4ETSHRLMNAALDH1A1MAPT | |
| SCHEMBL2002866 | 0.87 | FAAH (0.41) | FAAH |
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 |