Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.57 |
| ▸ | RAB9A | P51151 | 7/20 | 0.57 |
| ▸ | GRM5 | P41594 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7305442 | 0.81 | NPC1 (0.46) | NPC1RAB9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL26456095 | 0.81 | TAS1R3 (0.69) | MEN1KMT2ATAS1R3TAS1R1TAS1R2 | |
| SCHEMBL15219382 | 0.79 | NPC1 (0.62) | NPC1RAB9AGRM5MEN1KMT2A | |
| SCHEMBL29953036 | 0.79 | L3MBTL1 (0.50) | NPC1RAB9AMEN1KMT2AHPGD | |
| SCHEMBL15535810 | 0.78 | RAB9A (0.65) | NPC1RAB9AGRM5KMT2AHTR2B | |
| SCHEMBL2476158 | 0.78 | NPC1 (0.56) | NPC1RAB9AGRM5MEN1KMT2A | |
| SCHEMBL23360960 | 0.78 | NPC1 (0.58) | NPC1RAB9AGRM5MEN1KMT2A | |
| SCHEMBL13294374 | 0.78 | GRM5 (0.81) | NPC1RAB9AGRM5MEN1KMT2A | |
| SCHEMBL23385296 | 0.78 | NPC1 (0.58) | NPC1RAB9AGRM5MEN1KMT2A | |
| SCHEMBL435720 | 0.78 | KMT2A (0.69) | NPC1RAB9AMEN1KMT2AHTR2B |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |