Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.31 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | CLK1 | P49759 | 1/20 | 0.30 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL27678355 | 0.75 | SMN1; SMN2 (0.40) | MEN1KMT2ASMN1; SMN2HIF1ASIRT2 | |
| SCHEMBL27584339 | 0.75 | CTSB (0.47) | MEN1KMT2ASMN1; SMN2HIF1AALDH1A1 | |
| SCHEMBL4937591 | 0.75 | SMN1; SMN2 (0.66) | SMN1; SMN2HIF1AALDH1A1SLC7A5CTSB | |
| SCHEMBL6464407 | 0.75 | SMN1; SMN2 (0.66) | SMN1; SMN2HIF1AALDH1A1SLC7A5CTSB | |
| SCHEMBL16553913 | 0.74 | SMN1; SMN2 (0.47) | MEN1KMT2ASMN1; SMN2HIF1AALDH1A1 | |
| SCHEMBL27850077 | 0.74 | SMN1; SMN2 (0.47) | MEN1KMT2ASMN1; SMN2HIF1AALDH1A1 | |
| SCHEMBL15418113 | 0.74 | MTNR1A (0.39) | MEN1KMT2AFAAHSIRT2ALDH1A1 | |
| SCHEMBL26697003 | 0.73 | NPSR1 (0.47) | SIRT2ALDH1A1HPGDNPSR1 | |
| SCHEMBL27487742 | 0.73 | CTSS (0.47) | MEN1KMT2ASMN1; SMN2HIF1AALDH1A1 | |
| SCHEMBL27515011 | 0.73 | CTSB (0.47) | MEN1KMT2ASMN1; SMN2HIF1AALDH1A1 |
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-102834397-A | Macrocyclic compounds as factor XIA inhibitors | BRISTOL MYERS SQUIBB CO | 2012-12-19 | — | — | CN | disclosed |