Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | HTR7 | P34969 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.53 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8902078 | 0.99 | ALDH1A1 (0.55) | ALDH1A1MAPK1LMNAMAPTHPGD | |
| SCHEMBL8092824 | 0.83 | SIGMAR1 (0.59) | ALDH1A1MAPK1LMNAMAPTHPGD | |
| SCHEMBL9042120 | 0.82 | ALDH1A1 (0.57) | ALDH1A1MAPK1MAPTHTTSMN1; SMN2 | |
| SCHEMBL4198757 | 0.80 | NAMPT (0.65) | ALDH1A1MAPK1LMNAMAPTHPGD | |
| SCHEMBL15840488 | 0.80 | ALDH1A1 (0.52) | ALDH1A1MAPK1LMNAMAPTHPGD | |
| SCHEMBL6245254 | 0.78 | NAMPT (0.64) | ALDH1A1MAPK1LMNAMAPTHPGD | |
| SCHEMBL8091568 | 0.78 | MEN1 (0.54) | ALDH1A1MAPK1LMNAMAPTHPGD | |
| SCHEMBL7396649 | 0.78 | HDAC6 (0.53) | ALDH1A1SIGMAR1POLBNPC1RAB9A | |
| SCHEMBL7398844 | 0.78 | HDAC6 (0.53) | ALDH1A1SIGMAR1POLBNPC1RAB9A | |
| SCHEMBL9377300 | 0.78 | DRD2 (0.53) | ALDH1A1MAPK1LMNAMAPTHPGD |
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-1997014689-A1 | ARYL-PIPERAZINE CYCLIC AMINE DERIVATIVES, PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | PIERRE FABRE MEDICAMENT (FR) | 1997-04-24 | — | — | WO | disclosed |