Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 9/20 | 0.40 |
| ▸ | KCNA2 | P16389 | 1/20 | 0.35 |
| ▸ | KCNA4 | P22459 | 1/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30911911 | 0.86 | KCNA3 (0.40) | KCNA3KCNA2KCNA4KCNA5KCNA1 | |
| SCHEMBL1340150 | 0.84 | ALDH1A1 (0.41) | KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL16844565 | 0.80 | KCNA3 (0.41) | KCNA3KDM4EALDH1A1HPGDMAPT | |
| SCHEMBL16844527 | 0.79 | KCNA3 (0.40) | KCNA3KCNH2 | |
| SCHEMBL1339583 | 0.78 | CYP4F2 (0.47) | ALDH1A1MAPT | |
| SCHEMBL21951041 | 0.76 | KCNA3 (0.38) | KCNA3KCNA2KCNA5KCNA1KDM4E | |
| SCHEMBL29197425 | 0.76 | KCNA3 (0.38) | KCNA3KCNA2KCNA4KCNA5KCNA1 | |
| SCHEMBL30753215 | 0.76 | KCNA3 (0.38) | KCNA3KCNA2KCNA4KCNA5KCNA1 | |
| SCHEMBL17843510 | 0.74 | CYP1A2 (0.39) | ALDH1A1HPGD | |
| SCHEMBL25403991 | 0.73 | ALDH1A1 (0.41) | KDM4EALDH1A1HPGDMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015095261-A1 | NOVEL TRICYCLIC CALCIUM SENSING RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2015-06-25 | — | — | WO | disclosed |
| WO-2015089842-A1 | NOVEL TRICYCLIC CALCIUM SENSING RECEPTOR ANTAGONISTS FOR THE TREATMENT OF OSTEOPOROSIS | MERCK SHARP & DOHME CORP. (US) | 2015-06-25 | — | — | WO | disclosed |