Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19870686 | 0.84 | TP53 (0.41) | — | |
| SCHEMBL19870678 | 0.84 | HDAC4 (0.31) | — | |
| SCHEMBL11883539 | 0.81 | CES2 (0.30) | — | |
| SCHEMBL9770695 | 0.74 | ALDH1A1 (0.37) | ALDH1A1 | |
| SCHEMBL9079561 | 0.72 | TP53 (0.39) | ALDH1A1 | |
| SCHEMBL18870470 | 0.71 | KCNH2 (0.30) | — | |
| SCHEMBL25027774 | 0.71 | CD44 (0.38) | ALDH1A1HTR2CHTR2B | |
| SCHEMBL17019720 | 0.71 | MAOA (0.31) | — | |
| SCHEMBL17019672 | 0.71 | MAOA (0.31) | — | |
| SCHEMBL26607001 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4987261-A | Diaminoindane derivatives | MITSUI TOATSU CHEMICALS, INC. (JP) | 1991-01-22 | — | — | US | disclosed |
| US-4572796-A | 1,1,4,7-Tetramethyl-3-indanone, product produced thereby and organoleptic uses thereof | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 1986-02-25 | — | — | US | disclosed |