Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 7/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4707117 | 0.90 | TACR1 (0.45) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL4708394 | 0.90 | RXFP1 (0.44) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL4706712 | 0.84 | TP53 (0.52) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL4705917 | 0.81 | IDH1 (0.50) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL4707099 | 0.80 | MAPT (0.44) | TP53MAPTPOLBSMN1; SMN2 | |
| SCHEMBL4705947 | 0.80 | MAPT (0.44) | TP53MAPTPOLBSMN1; SMN2 | |
| SCHEMBL4705941 | 0.80 | TP53 (0.50) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL5793962 | 0.79 | CYP2D6 (0.39) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL4706587 | 0.79 | IDH1 (0.52) | TP53MAPTKMT2AMEN1POLB | |
| SCHEMBL4706152 | 0.78 | RXFP1 (0.47) | TP53MAPTKMT2AMEN1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |