Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.71 |
| ▸ | MEN1 | O00255 | 2/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | MMP1 | P03956 | 1/20 | 0.52 |
| ▸ | MMP2 | P08253 | 1/20 | 0.52 |
| ▸ | MMP9 | P14780 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
| ▸ | MMP13 | P45452 | 1/20 | 0.52 |
| ▸ | F2 | P00734 | 1/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.49 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.49 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.49 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12354240 | 0.83 | KMT2A (0.66) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL15334448 | 0.83 | KMT2A (1.00) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL14163384 | 0.82 | KMT2A (0.97) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL12481279 | 0.80 | KMT2A (0.94) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL34474241 | 0.80 | KMT2A (0.94) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL30737179 | 0.80 | KMT2A (0.88) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL2821240 | 0.80 | KMT2A (0.88) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL21994678 | 0.78 | MEN1 (0.51) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL810108 | 0.78 | MEN1 (0.51) | KMT2AMEN1ALDH1A1MAPTCA1 | |
| SCHEMBL5796406 | 0.75 | ALDH1A1 (0.65) | ALDH1A1MMP1MMP2MMP9MMP13 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1317445-A2 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS | ANORMED INC. (CA) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002022600-A2 | CHEMOKINE RECEPTOR BINDING HETEROCYCLIC COMPOUNDS | ANORMED INC. (CA) | 2002-03-21 | — | — | WO | disclosed |