Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28223602 | 1.00 | ABCB1 (0.37) | ABCB1DPP7TSHRALDH1A1CCR6 | |
| SCHEMBL8959083 | 1.00 | ABCB1 (0.37) | ABCB1DPP7TSHRALDH1A1CCR6 | |
| SCHEMBL27150036 | 1.00 | ABCB1 (0.37) | ABCB1DPP7TSHRALDH1A1CCR6 | |
| SCHEMBL27137245 | 1.00 | ABCB1 (0.37) | ABCB1DPP7TSHRALDH1A1CCR6 | |
| SCHEMBL2130748 | 0.98 | TSHR (0.36) | ABCB1DPP7TSHRALDH1A1CCR6 | |
| SCHEMBL16760609 | 0.91 | CCR5 (0.40) | ABCB1TSHRCCR5 | |
| SCHEMBL9062253 | 0.91 | CCR5 (0.40) | ABCB1TSHRCCR5 | |
| SCHEMBL11229187 | 0.91 | CCR5 (0.40) | ABCB1TSHRCCR5 | |
| SCHEMBL15467638 | 0.91 | CCR5 (0.40) | ABCB1TSHRCCR5 | |
| SCHEMBL9801267 | 0.91 | CCR5 (0.40) | ABCB1TSHRCCR5 |
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-2024043341-A1 | CYCLOALKYNE DERIVATIVE | ペプチドリーム株式会社 | 2024-02-29 | — | — | WO | disclosed |