Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | ACACB | O00763 | 1/20 | 0.46 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.45 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 3/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | NAMPT | P43490 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GYS1 | P13807 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16015484 | 0.88 | KMT2A (0.55) | KMT2AMEN1ACACBHSD17B1HSD17B2 | |
| SCHEMBL20109733 | 0.88 | KMT2A (0.55) | KMT2AMEN1HSD17B1HSD17B2PDK2 | |
| SCHEMBL28897045 | 0.80 | HSD17B1 (0.55) | KMT2AMEN1ACACBHSD17B1HSD17B2 | |
| SCHEMBL5037059 | 0.80 | KMT2A (0.57) | KMT2AMEN1ACACBPDK2CDK4 | |
| SCHEMBL12334126 | 0.77 | PARP1 (0.55) | KMT2AMEN1HSD17B1HSD17B2PARP1 | |
| SCHEMBL1006489 | 0.77 | NAMPT (0.54) | KMT2AMEN1PDK2ACHECDK4 | |
| SCHEMBL1696479 | 0.77 | KMT2A (0.57) | KMT2AMEN1L3MBTL1CDK4CCND1 | |
| SCHEMBL25467798 | 0.76 | KMT2A (0.53) | KMT2AMEN1HSD17B1HSD17B2L3MBTL1 | |
| SCHEMBL18717239 | 0.75 | L3MBTL1 (0.55) | KMT2AMEN1HSD17B1HSD17B2PDK2 | |
| SCHEMBL10268480 | 0.75 | KMT2A (0.55) | KMT2AMEN1HSD17B1HSD17B2PDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2534152-B1 | MACROCYCLES AS FACTOR XIA INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-05-02 | — | — | EP | disclosed |