Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.71 |
| ▸ | RAB9A | P51151 | 4/20 | 0.71 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 2/20 | 0.71 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.61 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.60 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | STAT3 | P40763 | 1/20 | 0.59 |
| ▸ | FABP1 | P07148 | 1/20 | 0.58 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.58 |
| ▸ | NAMPT | P43490 | 1/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.57 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.55 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10282271 | 0.91 | NPC1 (0.80) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL15450964 | 0.91 | NPC1 (0.80) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL16589432 | 0.87 | PTPN1 (0.80) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL23484358 | 0.85 | NPC1 (0.89) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL15305949 | 0.85 | PTPN1 (0.71) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL15214314 | 0.84 | RAB9A (0.88) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL17066707 | 0.84 | RAB9A (0.88) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL82305 | 0.84 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL25491824 | 0.84 | RAB9A (0.88) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 | |
| SCHEMBL25970267 | 0.84 | RAB9A (0.88) | NPC1RAB9ASMN1; SMN2MAPTPTPN1 |
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-2012012612-A2 | TETRAZINE-TRANS-CYCLOOCTENE LIGATION FOR THE RAPID CONSTRUCTION OF RADIONUCLIDE LABELED PROBES | UNIVERSITY OF DELAWARE (US) | 2012-01-26 | — | — | WO | disclosed |