Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.66 |
| ▸ | AURKA | O14965 | 2/20 | 0.52 |
| ▸ | CTSC | P53634 | 1/20 | 0.52 |
| ▸ | IL1B | P01584 | 1/20 | 0.49 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | NOS3 | P29474 | 1/20 | 0.49 |
| ▸ | NOS2 | P35228 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18672951 | 0.85 | NPC1 (0.47) | KIF11IL1BNLRP3KMT2AMEN1 | |
| SCHEMBL22971132 | 0.81 | KIF11 (0.60) | KIF11AURKACTSCIL1BNLRP3 | |
| SCHEMBL20172494 | 0.80 | KIF11 (0.59) | KIF11CTSCIL1BNLRP3 | |
| SCHEMBL22970832 | 0.80 | ALOX15 (0.51) | KIF11AURKATSHRNOS3NOS2 | |
| SCHEMBL4184375 | 0.78 | AURKA (0.55) | KIF11AURKACTSCNOS3NOS2 | |
| SCHEMBL31240789 | 0.76 | ABL1 (0.48) | KIF11CTSCKMT2AMEN1 | |
| SCHEMBL17969552 | 0.76 | MAPK8 (0.45) | KIF11TSHRKMT2AMEN1 | |
| SCHEMBL5748960 | 0.76 | KARS1 (0.58) | KIF11NOS2 | |
| SCHEMBL14577133 | 0.76 | KIF11 (0.71) | KIF11CTSCIL1BNLRP3TSHR | |
| SCHEMBL1518621 | 0.75 | MAPK10 (0.67) | AURKAKMT2AMEN1 |
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-3137459-B1 | MORPHOLIN-PYRIDINE DERIVATIVES HAVING AFFINITY TO THE TAAR1 RECEPTOR | HOFFMANN LA ROCHE (CH) | 2018-05-23 | — | — | EP | disclosed |