Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR1 | P25024 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24783593 | 0.94 | CXCR1 (0.51) | CXCR1NPC1RAB9AACHEMAPT | |
| SCHEMBL30133015 | 0.94 | CXCR1 (0.51) | CXCR1NPC1RAB9AACHEMAPT | |
| SCHEMBL24784177 | 0.93 | ACHE (0.51) | NPC1RAB9AACHEMAPTPOLB | |
| SCHEMBL24784178 | 0.91 | NPC1 (0.56) | NPC1RAB9AMAPTNPSR1TSHR | |
| SCHEMBL30133010 | 0.91 | NPC1 (0.56) | NPC1RAB9AMAPTNPSR1TSHR | |
| SCHEMBL30133020 | 0.87 | ACP1 (0.48) | CXCR1NPC1RAB9AACHEMAPT | |
| SCHEMBL24783591 | 0.87 | ACP1 (0.48) | CXCR1NPC1RAB9AACHEMAPT | |
| SCHEMBL24783691 | 0.87 | ACP1 (0.49) | CXCR1ACHEMAPTPOLBSMN1; SMN2 | |
| SCHEMBL24784179 | 0.84 | TSHR (0.57) | CXCR1MAPTPOLBSMN1; SMN2TSHR | |
| SCHEMBL30133014 | 0.84 | TSHR (0.57) | CXCR1MAPTPOLBSMN1; SMN2TSHR |
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-2022261296-A1 | COMPOUNDS THAT BIND NON-CANONICAL G-QUADRUPLEX STRUCTURES AND METHODS OF MAKING AND USING THE SAME | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2022-12-15 | — | — | WO | disclosed |