Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 7/20 | 0.51 |
| ▸ | HTR2A | P28223 | 6/20 | 0.51 |
| ▸ | HTR2C | P28335 | 6/20 | 0.51 |
| ▸ | HTR2B | P41595 | 6/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.50 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 5/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31599138 | 1.00 | SIGMAR1 (0.51) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL15692839 | 0.92 | ALDH1A1 (0.54) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL11705043 | 0.91 | SIGMAR1 (0.45) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL30303547 | 0.90 | ALDH1A1 (0.57) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL7887209 | 0.90 | SIGMAR1 (0.60) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL7887715 | 0.88 | SIGMAR1 (0.54) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL1912720 | 0.87 | POLB (0.46) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| SCHEMBL29790919 | 0.87 | SIGMAR1 (0.45) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| Hydrochloric Acid SCHEMBL31318803 | 0.85 | SIGMAR1 (0.46) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 | |
| Hydrochloric Acid SCHEMBL3226212 | 0.85 | SIGMAR1 (0.46) | SIGMAR1HTR2AHTR2CHTR2BNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-55007209-A | — | — | None | — | — | JP | disclosed |
| JP-S557209-A | SPIROCYCLOPROPANE-1',2'-INDANE DERIVATIVE AND ITS PREPARATION | MITSUI PETROCHEM IND LTD | 1980-01-19 | — | — | JP | disclosed |