Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 5/20 | 0.44 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.40 |
| ▸ | GPR6 | P46095 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL6457296 | 1.00 | KDM4E (0.50) | KDM4ELMNASMN1; SMN2SIGMAR1RXFP1 | |
| SCHEMBL6455439 | 0.95 | KDM4E (0.55) | KDM4ELMNASMN1; SMN2SIGMAR1RXFP1 | |
| SCHEMBL6455435 | 0.95 | KDM4E (0.55) | KDM4ELMNASMN1; SMN2SIGMAR1RXFP1 | |
| Trifluoroacetic Acid SCHEMBL6457352 | 0.88 | KDM4E (0.51) | KDM4ELMNASMN1; SMN2MCHR1ADRA2A | |
| Trifluoroacetic Acid SCHEMBL6462476 | 0.85 | MCHR1 (0.61) | KDM4ELMNASMN1; SMN2MCHR1ADRA2A | |
| Trifluoroacetic Acid SCHEMBL6460104 | 0.81 | MCHR1 (0.60) | KDM4ELMNASMN1; SMN2RXFP1MCHR1 | |
| SCHEMBL6461515 | 0.80 | MCHR1 (0.66) | KDM4ELMNASMN1; SMN2MCHR1ADRA2A | |
| SCHEMBL6461509 | 0.80 | MCHR1 (0.66) | KDM4ELMNASMN1; SMN2MCHR1ADRA2A | |
| Trifluoroacetic Acid SCHEMBL6460864 | 0.80 | LMNA (0.54) | KDM4ELMNASMN1; SMN2RXFP1MCHR1 | |
| Hydrochloric Acid SCHEMBL6457539 | 0.79 | MCHR1 (0.65) | KDM4ELMNASMN1; SMN2MCHR1ADRA2A |
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-2004087669-A1 | NOVEL QUINOLINE, TETRAHYDROQUINAZOLINE, AND PYRIMIDINE DERIVATIVES AND METHODS OF TREATMENT RELATED TO THE USE THEREOF | TAISHO PHARMACEUTICAL CO. LTD. (JP) | 2004-10-14 | — | — | WO | disclosed |