Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | TDO2 | P48775 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.33 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.33 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8378504 | 0.78 | ALDH1A1 (0.34) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL8380298 | 0.77 | HTR1A (0.34) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL8377229 | 0.76 | KIF11 (0.32) | KIF11 | |
| SCHEMBL8377243 | 0.73 | TNFRSF1A (0.38) | ALDH1A1HSD17B10MAPK8MAPK9MAPK10 | |
| SCHEMBL8379339 | 0.73 | HTR1A (0.36) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL8636164 | 0.72 | LMNA (0.39) | IDO1TDO2ALDH1A1HTR1AADRA1D | |
| SCHEMBL8378913 | 0.71 | ALDH1A1 (0.39) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL8377093 | 0.71 | SLC6A5 (0.37) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL8377272 | 0.70 | HTR1A (0.34) | ALDH1A1HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL9065459 | 0.69 | KIF11 (0.33) | IDO1TDO2KIF11 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5883248-A | QUATERNARY AMMONIUM INTERMEDIATES | ROUSSEL UCLAF (FR) | 1999-03-16 | — | — | US | disclosed |
| US-5763617-A | Cephalosporins | ROUSSEL UCLAF (FR) | 1998-06-09 | — | — | US | disclosed |
| US-5712266-A | Cephalosporins | ROUSSEL UCLAF (FR) | 1998-01-27 | — | — | US | disclosed |