Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.49 |
| ▸ | ESR1 | P03372 | 6/20 | 0.46 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29771818 | 0.86 | ESR1 (0.46) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL17445867 | 0.86 | ESR1 (0.46) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL30845731 | 0.84 | CYP1A2 (0.46) | CYP1A2TSHRHIF1AHSD17B10TDP1 | |
| SCHEMBL787068 | 0.84 | CYP1A2 (0.46) | CYP1A2TSHRHIF1AHSD17B10TDP1 | |
| SCHEMBL17445866 | 0.84 | MCL1 (0.46) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL2770679 | 0.80 | CYP1A2 (0.46) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL2773224 | 0.80 | CYP1A2 (0.46) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL11054996 | 0.79 | CYP1A2 (0.55) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL31433385 | 0.78 | DYRK1A (0.54) | DYRK1AESR1ESR2CYP1A2CYP3A4 | |
| SCHEMBL28142951 | 0.78 | DYRK1A (0.43) | DYRK1AESR1ESR2CYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3801507-A2 | TOMM6-INTERACTING EXTRACTS AND COMPOUNDS FOR USE IN THE TREATMENT AND PROPHYLAXIS OF NERVOUS SYSTEM DISEASES, ATHEROSCLEROSIS, HEPATITIS B INFECTION AND HUMAN PAPILLOMA VIRUS (HPV) INFECTION | ETH Zurich (CH) | 2021-04-14 | — | — | EP | claimed |