Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | F10 | P00742 | 9/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
| ▸ | RELA | Q04206 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.49 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.49 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.49 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29738283 | 1.00 | RAB9A (0.51) | RAB9ANPC1F10KMT2ATP53 | |
| SCHEMBL12161641 | 0.80 | RAB9A (0.56) | RAB9ANPC1F10KMT2ATP53 | |
| SCHEMBL28481464 | 0.77 | MEN1 (0.58) | RAB9ANPC1F10KMT2ATP53 | |
| SCHEMBL11112523 | 0.74 | NPSR1 (0.60) | RAB9ANPC1F10KMT2ATP53 | |
| SCHEMBL3924687 | 0.72 | MKNK1 (0.42) | SMN1; SMN2 | |
| SCHEMBL16209815 | 0.71 | KCNMA1 (0.60) | RAB9ANPC1KMT2ATP53MEN1 | |
| SCHEMBL28734370 | 0.71 | KCNMA1 (0.82) | RAB9ANPC1KMT2ATP53MEN1 | |
| SCHEMBL11826793 | 0.71 | PDCD1 (0.72) | RAB9ANPC1F10KMT2ATP53 | |
| SCHEMBL3669943 | 0.71 | LRRK2 (0.38) | — | |
| SCHEMBL6302474 | 0.71 | NNMT (0.42) | RAB9ASMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114644627-B | AhR inhibitors and uses thereof | 山东轩竹医药科技有限公司 | 2024-06-11 | — | — | CN | disclosed |
| CN-114644627-A | AhR inhibitor and application thereof | 山东轩竹医药科技有限公司 | 2022-06-21 | — | — | CN | disclosed |