Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 5/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.38 |
| ▸ | FABP2 | P12104 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.38 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL7468946 | 0.84 | CYP11B1 (0.42) | MEN1KMT2ACYP2C19TSHRLMNA | |
| SCHEMBL7467261 | 0.84 | CYP1A1 (0.41) | MEN1KMT2ACYP2C19CYP1A2MAPT | |
| SCHEMBL4905103 | 0.82 | PTGS1 (0.38) | PTGS1PTGS2MEN1KMT2ACYP2C19 | |
| SCHEMBL357701 | 0.82 | CYP11B1 (0.40) | MEN1KMT2ACYP2C19TSHRLMNA | |
| SCHEMBL8131636 | 0.81 | ERN1 (0.43) | PTGS1PTGS2HTR2CMAPTBACE1 | |
| SCHEMBL3144056 | 0.81 | PDGFRB (0.41) | PTGS2ABCB1PGR | |
| SCHEMBL7466430 | 0.79 | CYP1A1 (0.44) | KMT2ACYP2C19LMNACYP1A2MAPT | |
| SCHEMBL7471853 | 0.79 | ESR2 (0.39) | MEN1KMT2ALMNAMAPTHPGD | |
| SCHEMBL7472137 | 0.78 | ESR2 (0.39) | PTGS1PTGS2EGFR | |
| SCHEMBL7458294 | 0.78 | AKR1C3 (0.40) | AKR1C3AKR1C2AKR1C4AKR1C1PGR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1244617-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | Ortho-McNeil Pharmaceutical, Inc. (US) | 2002-10-02 | — | — | EP | claimed |
| WO-2001047875-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-07-05 | — | — | WO | claimed |