Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP7 | P09237 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20799656 | 0.99 | HPGD (0.41) | SMN1; SMN2NPC1RAB9AHTTHPGD | |
| SCHEMBL20799682 | 0.93 | HRH4 (0.39) | SMN1; SMN2NPC1RAB9AHTTHRH4 | |
| SCHEMBL20799678 | 0.83 | NPC1 (0.42) | SMN1; SMN2NPC1RAB9AHTTMMP1 | |
| SCHEMBL20799671 | 0.79 | ALDH1A1 (0.44) | SMN1; SMN2NPC1RAB9AHTTMMP1 | |
| SCHEMBL20559473 | 0.77 | HTR2B (0.40) | HPGDHRH4 | |
| SCHEMBL20559472 | 0.77 | HTR2B (0.40) | HPGDHRH4 | |
| SCHEMBL19146628 | 0.77 | HTR2B (0.40) | HPGDHRH4 | |
| SCHEMBL20559193 | 0.77 | HTR2B (0.40) | HPGDHRH4 | |
| SCHEMBL20559557 | 0.77 | HTR2B (0.40) | HPGDHRH4 | |
| SCHEMBL20559191 | 0.77 | HTR2B (0.40) | HPGDHRH4 |
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-2017122754-A1 | VOLTAGE-DEPENDENT T-TYPE CALCIUM CHANNEL INHIBITOR | 日本ケミファ株式会社 | 2017-07-20 | — | — | WO | disclosed |