Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | BLM | P54132 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1416007 | 0.84 | NPSR1 (0.41) | NPSR1ALOX5ALDH1A1TSHRGLA | |
| SCHEMBL13144272 | 0.82 | KMT2A (0.48) | NPSR1ALDH1A1TSHRGLARECQL | |
| SCHEMBL15786490 | 0.82 | NPSR1 (0.40) | NPSR1ALOX5ALDH1A1TSHRGLA | |
| SCHEMBL3258421 | 0.78 | NPSR1 (0.43) | NPSR1ALOX5ALDH1A1TSHRGLA | |
| SCHEMBL11074660 | 0.76 | NPSR1 (0.41) | NPSR1ALOX5ALDH1A1TSHRGLA | |
| SCHEMBL19957298 | 0.76 | MEN1 (0.36) | NPSR1ALDH1A1TSHRGLARECQL | |
| SCHEMBL27867642 | 0.74 | MEN1 (0.37) | NPSR1ALDH1A1TSHRRECQLCYP3A4 | |
| SCHEMBL10348319 | 0.73 | NPSR1 (0.39) | NPSR1ALOX5ALDH1A1TSHRGLA | |
| SCHEMBL23869841 | 0.69 | MEN1 (0.33) | ALDH1A1RECQLMAPTPOLBBLM | |
| SCHEMBL1630634 | 0.69 | KMT2A (0.50) | NPSR1ALOX5POLBL3MBTL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-101238131-A | Bridged piperazine and piperidine derivatives as CCR1 antagonists | NOVARTIS AG (CH) | 2008-08-06 | — | — | CN | disclosed |