Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 5/20 | 0.36 |
| ▸ | HTR2C | P28335 | 5/20 | 0.36 |
| ▸ | HTR2B | P41595 | 5/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | APAF1 | O14727 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.35 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16230166 | 0.93 | TNKS (0.37) | TNKSHTR2AHTR2CHTR2BSIGMAR1 | |
| SCHEMBL822777 | 0.74 | SMN1; SMN2 (0.44) | TNKSSMN1; SMN2ALDH1A1NPC1KDM4E | |
| SCHEMBL18926478 | 0.73 | SMN1; SMN2 (0.41) | TNKSSMN1; SMN2ALDH1A1NPC1KDM4E | |
| SCHEMBL7887209 | 0.70 | SIGMAR1 (0.60) | HTR2AHTR2CHTR2BSIGMAR1ALDH1A1 | |
| SCHEMBL16478048 | 0.70 | MAOA (0.44) | TNKSSMN1; SMN2ALDH1A1NPC1KDM4E | |
| SCHEMBL30785 | 0.70 | TDP1 (0.54) | HTR2AHTR2CHTR2BSIGMAR1NPSR1 | |
| SCHEMBL7887821 | 0.70 | HTR2A (0.45) | HTR2AHTR2CHTR2BSIGMAR1MAPT | |
| SCHEMBL7893219 | 0.70 | SIGMAR1 (0.40) | HTR2AHTR2CHTR2BSIGMAR1ALDH1A1 | |
| SCHEMBL1463869 | 0.69 | TDP1 (0.53) | HTR2AHTR2CHTR2BSIGMAR1NPSR1 | |
| SCHEMBL26892187 | 0.69 | TNKS (0.39) | TNKSSMN1; SMN2ALDH1A1NPC1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2406240-B1 | INHIBITORS OF BETA-SECRETASE | VITAE PHARMACEUTICALS INC (US) | 2015-12-23 | — | — | EP | disclosed |