Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2731444 | 0.83 | KMT2A (0.45) | ALDH1A1TSHRKMT2AHPGDPKM | |
| SCHEMBL2732579 | 0.83 | KMT2A (0.45) | ALDH1A1TSHRKMT2AHPGDPKM | |
| SCHEMBL2730327 | 0.79 | KMT2A (0.67) | ALDH1A1TSHRKMT2AHPGDPKM | |
| SCHEMBL2731678 | 0.75 | KMT2A (0.54) | ALDH1A1TSHRKMT2ANPSR1PKM | |
| SCHEMBL15825106 | 0.75 | KMT2A (0.71) | KMT2ALMNAUSP2 | |
| SCHEMBL2729430 | 0.74 | KCNJ1 (0.65) | ALDH1A1TSHRKMT2AHPGDPKM | |
| SCHEMBL4580901 | 0.73 | ALDH1A1 (0.49) | ALDH1A1TSHRKMT2AHPGDNPSR1 | |
| SCHEMBL15018034 | 0.73 | KCNJ1 (0.49) | ALDH1A1TSHRKMT2AHPGD | |
| SCHEMBL17232502 | 0.72 | ALDH1A1 (0.67) | ALDH1A1TSHRKMT2APKMLMNA | |
| SCHEMBL153056 | 0.71 | CA12 (0.59) | ALDH1A1TSHRKMT2ALMNA |
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-2632464-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | Merck Sharp & Dohme Corp. (US) | 2013-09-04 | — | — | EP | disclosed |
| WO-2012058134-A1 | INHIBITORS OF THE RENAL OUTER MEDULLARY POTASSIUM CHANNEL | MERCK SHARP & DOHME CORP. (US) | 2012-05-03 | — | — | WO | disclosed |