Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 2/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | ACP1 | P24666 | 3/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.35 |
| ▸ | ITK | Q08881 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22235634 | 0.87 | RXFP1 (0.46) | KITPDGFRAKDRAURKARPS6KB1 | |
| SCHEMBL22258475 | 0.86 | NPC1 (0.49) | RXFP1NPC1MAPTRECQLRAB9A | |
| SCHEMBL22258490 | 0.85 | SMN1; SMN2 (0.40) | NOS1NOS2KDRRAB9AJAK2 | |
| SCHEMBL22258247 | 0.81 | CDK5 (0.49) | AURKARPS6KB1ACP1 | |
| SCHEMBL22258549 | 0.78 | LTA4H (0.47) | NPC1RAB9ASMN1; SMN2TSHR | |
| SCHEMBL22258491 | 0.77 | RAB9A (0.37) | NOS2KDRNPC1MAPTRECQL | |
| SCHEMBL22258553 | 0.76 | HSD17B10 (0.40) | SMN1; SMN2TSHRHSD17B10 | |
| SCHEMBL22258481 | 0.74 | EGFR (0.55) | KDRJAK3NPC1MAPTRAB9A | |
| SCHEMBL22258552 | 0.72 | LTA4H (0.48) | KDRMAPTSMN1; SMN2ALDH1A1CYP2D6 | |
| SCHEMBL22236104 | 0.70 | RXFP1 (0.47) | KITKDRRXFP1JAK3NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020150545-A1 | PYRAZOLE DERIVATIVES AS MODULATORS OF THE WNT/B-CATENIN SIGNALING PATHWAY | SAMUMED, LLC (US) | 2020-07-23 | — | — | WO | disclosed |