Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.60 |
| ▸ | KARS1 | Q15046 | 3/20 | 0.53 |
| ▸ | NOS2 | P35228 | 1/20 | 0.53 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.46 |
| ▸ | ITGAV | P06756 | 2/20 | 0.46 |
| ▸ | ITGB5 | P18084 | 2/20 | 0.46 |
| ▸ | ITGB6 | P18564 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24709836 | 0.93 | KDM4D (0.54) | KDM4DKARS1NOS2NUDT1KMT2A | |
| SCHEMBL828151 | 0.89 | KARS1 (0.63) | KDM4DKARS1NOS2KMT2AMEN1 | |
| SCHEMBL7108041 | 0.83 | KDM4E (0.56) | KARS1NOS2KMT2AMEN1POLB | |
| SCHEMBL7833347 | 0.83 | KARS1 (0.64) | KARS1NOS2KMT2AMEN1POLB | |
| SCHEMBL18386507 | 0.81 | KDM4E (0.58) | KARS1NOS2KMT2AMEN1POLB | |
| SCHEMBL7170034 | 0.81 | ITGB3 (0.54) | KDM4DKARS1NOS2KMT2AMEN1 | |
| SCHEMBL11961829 | 0.80 | NOS2 (0.57) | KARS1NOS2KMT2AMEN1POLB | |
| SCHEMBL8277611 | 0.80 | SMN1; SMN2 (0.51) | KARS1NOS2KMT2AMEN1POLB | |
| SCHEMBL5856027 | 0.80 | ITGB3 (0.58) | KDM4DKARS1NOS2KMT2AMEN1 | |
| SCHEMBL26686532 | 0.79 | KDM4D (0.60) | KDM4DNUDT1KMT2AMEN1NPC1 |
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-2005105760-A1 | HETEROCYCLIC AMIDE COMPOUND AND USE THEREOF AS AN MMP-13 INHIBITOR | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2005-11-10 | — | — | WO | disclosed |