Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | EDNRB | P24530 | 4/20 | 0.43 |
| ▸ | EDNRA | P25101 | 4/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.43 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7934306 | 0.92 | EDNRB (0.46) | KDM4ELMNAEDNRBEDNRAALDH1A1 | |
| SCHEMBL7937196 | 0.86 | EDNRB (0.49) | EDNRBEDNRA | |
| SCHEMBL8098308 | 0.75 | EDNRB (0.50) | EDNRBEDNRA | |
| SCHEMBL7928120 | 0.75 | EDNRB (0.44) | KDM4ELMNAEDNRBEDNRAALDH1A1 | |
| SCHEMBL1069539 | 0.72 | EDNRB (0.55) | EDNRBEDNRANR1I2KCNE1KCNQ1 | |
| SCHEMBL7934325 | 0.72 | MAPT (0.43) | KDM4ELMNAEDNRBEDNRAPOLB | |
| SCHEMBL7937185 | 0.72 | EDNRA (0.44) | KDM4ELMNAEDNRAPOLBALDH1A1 | |
| SCHEMBL8109239 | 0.72 | EDNRB (0.57) | EDNRBEDNRA | |
| SCHEMBL8116655 | 0.69 | EDNRB (0.46) | EDNRBEDNRA | |
| SCHEMBL1068997 | 0.69 | KMT2A (0.50) | ALDH1A1MAPTCYP1A2CYP3A4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6235903-B1 | Method for preparing sulfanyl-type endothelin receptor antagonists | BASF AKTIENGESELLSCHAFT (DE) | 2001-05-22 | — | — | US | disclosed |