Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 6/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | HPSE | Q9Y251 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | C1S | P09871 | 1/20 | 0.34 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.33 |
| ▸ | SREBF2 | Q12772 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | CRHBP | P24387 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL20197267 | 0.87 | C1S (0.34) | CYP1B1CYP1A1CYP1A2HPSEMAPT | |
| SCHEMBL20197297 | 0.87 | CYP19A1 (0.35) | HPSEMAPTLMNARXFP1NPSR1 | |
| SCHEMBL20197220 | 0.86 | SREBF2 (0.35) | HPSEMAPTLMNARXFP1NPSR1 | |
| SCHEMBL20197221 | 0.83 | SREBF2 (0.55) | MAPTLMNAKDM4ESREBF2ATM | |
| SCHEMBL20197278 | 0.83 | CNR2 (0.39) | MAPTLMNARXFP1KDM4ESMN1; SMN2 | |
| SCHEMBL16535205 | 0.82 | SREBF2 (0.38) | CYP1B1CYP1A1CYP1A2HPSEMAPT | |
| SCHEMBL20197218 | 0.82 | MAPT (0.36) | CYP1B1CYP1A1CYP1A2HPSEMAPT | |
| SCHEMBL20197302 | 0.79 | SMN1; SMN2 (0.46) | CYP1B1CYP1A1CYP1A2MAPTLMNA | |
| SCHEMBL20197228 | 0.78 | CYP1A1 (0.42) | CYP1B1CYP1A1CYP1A2MAPTLMNA | |
| SCHEMBL20197336 | 0.77 | CYP19A1 (0.46) | CYP1B1CYP1A1CYP1A2MAPTLMNA |
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-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |