Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5616126 | 0.82 | NPC1 (0.57) | POLBEPHX2SMN1; SMN2LMNAPKM | |
| SCHEMBL30768879 | 0.76 | POLB (0.80) | POLBEPHX2SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL8358822 | 0.76 | MMP13 (0.69) | SMN1; SMN2CYP3A4LMNAHTTALDH1A1 | |
| SCHEMBL4719932 | 0.76 | MAPK14 (0.56) | CYP3A4ALDH1A1CYP2D6CYP2C9MMP13 | |
| SCHEMBL5615596 | 0.74 | ALDH1A1 (0.50) | POLBCYP3A4PKMALDH1A1KMT2A | |
| SCHEMBL5615640 | 0.73 | MMP13 (0.60) | SMN1; SMN2CYP3A4LMNAALDH1A1KMT2A | |
| SCHEMBL4720766 | 0.73 | MMP13 (0.73) | SMN1; SMN2CYP3A4LMNARAB9ACYP2D6 | |
| SCHEMBL8348717 | 0.73 | ROCK1 (0.65) | SMN1; SMN2CYP3A4LMNARAB9AKMT2A | |
| SCHEMBL4718560 | 0.73 | MMP13 (0.57) | CYP3A4LMNAALDH1A1CYP2D6CYP2C9 | |
| SCHEMBL4720432 | 0.73 | MMP13 (0.63) | SMN1; SMN2CYP3A4LMNAHTTALDH1A1 |
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-2004041788-A1 | NOVEL PYRIMIDINE-4,6-DICARBOXAMIDES FOR THE SELECTIVE INHIBITION OF COLLAGENASES | AVENTIS PHARMA DEUTSCHLAND GMBH (DE) | 2004-05-21 | — | — | WO | disclosed |