Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | VDR | P11473 | 1/20 | 0.37 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2001648 | 0.93 | RET (0.37) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2000706 | 0.91 | RET (0.39) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2003892 | 0.90 | L3MBTL1 (0.36) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2006154 | 0.90 | DRD2 (0.37) | LMNAMAPTALDH1A1CYP2C9CYP3A4 | |
| SCHEMBL2008461 | 0.90 | RET (0.36) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2006048 | 0.89 | LMNA (0.43) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2005502 | 0.89 | LMNA (0.38) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2002093 | 0.88 | LMNA (0.40) | LMNAMAPTALDH1A1ALOX12CYP2C9 | |
| SCHEMBL2001214 | 0.88 | PLA2G2A (0.38) | LMNAMAPTALDH1A1CYP2C9CYP3A4 | |
| SCHEMBL2003150 | 0.86 | S1PR1 (0.35) | LMNAMAPTALDH1A1CYP2C9CYP3A4 |
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 |