Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 2/20 | 0.43 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.39 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.39 |
| ▸ | AHR | P35869 | 4/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | IKBKB | O14920 | 1/20 | 0.32 |
| ▸ | CHUK | O15111 | 1/20 | 0.32 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.30 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.30 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.30 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30950714 | 0.77 | GPR84 (0.45) | AHRCYP2A6NR4A2PIM3TNF | |
| SCHEMBL1420429 | 0.75 | AHR (0.47) | CHEK1IMPDH2IMPDH1AHRXDH | |
| SCHEMBL31357932 | 0.75 | AHR (0.47) | CHEK1IMPDH2IMPDH1AHRXDH | |
| SCHEMBL30687262 | 0.75 | TNF (0.44) | CHEK1IMPDH2IMPDH1AHRTNF | |
| SCHEMBL19611745 | 0.74 | AHR (0.46) | CHEK1IMPDH2IMPDH1AHRCYP2A6 | |
| SCHEMBL22076299 | 0.72 | IMPDH2 (0.39) | CHEK1IMPDH2IMPDH1AHRCYP2A6 | |
| SCHEMBL10179175 | 0.71 | CSNK2A1 (0.41) | AHRCYP2A6NR4A2PIM3TNF | |
| SCHEMBL28834448 | 0.70 | DYRK1A (0.36) | CHEK1IMPDH2IMPDH1DYRK1ATNF | |
| SCHEMBL35212610 | 0.70 | TLR8 (0.37) | TNFRIPK1IKBKBCHUKGPR84 | |
| SCHEMBL30840801 | 0.69 | SLC22A12 (0.37) | IMPDH2IMPDH1AHRSLC22A12DYRK1A |
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-2023137634-A1 | TRICYCLIC COMPOUND, PREPARATION THEREFOR, PHARMACEUTICAL COMPOSITION AND USE | 上海奕拓医药科技有限责任公司 | 2023-07-27 | — | — | WO | disclosed |