Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 8/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.58 |
| ▸ | CYP1A1 | P04798 | 5/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 5/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.58 |
| ▸ | ESR1 | P03372 | 1/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.58 |
| ▸ | RELA | Q04206 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.55 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL8025906 | 0.81 | CYP1A2 (0.61) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL14345924 | 0.81 | CYP1A2 (0.63) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL14345763 | 0.80 | CYP1A2 (0.59) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL4704080 | 0.77 | CYP1A2 (0.58) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL14345706 | 0.75 | CYP1A2 (0.53) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL8794276 | 0.74 | KDM4E (0.68) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL878319 | 0.74 | GPR84 (0.50) | HTR2AHTR2CHSD17B10DRD2DRD1 | |
| SCHEMBL4699371 | 0.74 | CYP1A2 (0.53) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL31402832 | 0.73 | CYP1A1 (1.00) | CYP1A2KDM4ECYP1A1CYP1B1MAPT | |
| SCHEMBL14345707 | 0.73 | CYP1A2 (0.65) | CYP1A2KDM4ECYP1A1CYP1B1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6048868-A | CIRCADIAN RHYTHM DISORDERS; SLEEP DISORDERS; ANTIDEPRESSANTS | CEMAF (FR) | 2000-04-11 | — | — | US | disclosed |