Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.40 |
| ▸ | RAB9A | P51151 | 6/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | KIF11 | P52732 | 3/20 | 0.33 |
| ▸ | IKBKB | O14920 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5058981 | 0.72 | NPC1 (0.42) | NPC1RAB9ATP53SMN1; SMN2LMNA | |
| SCHEMBL25455048 | 0.69 | MAP4K4 (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL23432313 | 0.69 | NPC1 (0.49) | NPC1RAB9ATP53SMN1; SMN2LMNA | |
| SCHEMBL24174951 | 0.68 | TSHR (0.50) | NPC1RAB9ATP53SMN1; SMN2LMNA | |
| SCHEMBL24522126 | 0.68 | TSHR (0.48) | NPC1RAB9ATP53SMN1; SMN2LMNA | |
| SCHEMBL22600547 | 0.68 | CYP3A4 (0.34) | TP53SMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL23406367 | 0.67 | NPC1 (0.44) | NPC1RAB9ATP53SMN1; SMN2LMNA | |
| SCHEMBL6573941 | 0.66 | RAB9A (0.46) | NPC1RAB9ATP53SMN1; SMN2LMNA | |
| SCHEMBL22969925 | 0.66 | FFAR4 (0.35) | SMN1; SMN2TSHRKIF11GAA | |
| SCHEMBL25955331 | 0.66 | ALDH1A1 (0.30) | ALDH1A1TSHR |
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-2018048762-A1 | INDAZOLE DERIVATIVES USEFUL AS GLUCAGON RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2018-03-15 | — | — | WO | disclosed |