Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.66 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 3/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL25731888 | 0.84 | CHRM5 (0.68) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL23996033 | 0.82 | CHRM5 (0.60) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL31182402 | 0.80 | CHRM5 (0.72) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL27885399 | 0.80 | CHRM5 (0.72) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL14950238 | 0.80 | CHRM5 (0.72) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL23732607 | 0.80 | CHRM5 (0.62) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL7747064 | 0.80 | TAAR1 (0.58) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL17560805 | 0.80 | NPC1 (0.65) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL17560806 | 0.80 | NPC1 (0.65) | CHRM5TAAR1NPC1RAB9ACYP1A2 | |
| SCHEMBL7747066 | 0.80 | TAAR1 (0.58) | CHRM5TAAR1NPC1RAB9ACYP1A2 |
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-2023107552-A2 | PURINES AND METHODS OF THEIR USE | Kineta, Inc. (US) | 2023-06-15 | — | — | WO | disclosed |