Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PARG | Q86W56 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6643221 | 0.83 | HTR6 (0.39) | HTR6CYP1A2PTGES2MAPK1ACLY | |
| SCHEMBL3363006 | 0.77 | MAPT (0.43) | MAPTSMN1; SMN2KDM4EMEN1NPC1 | |
| SCHEMBL5237975 | 0.77 | PTGS2 (0.39) | MAPTSMN1; SMN2MEN1NPC1LMNA | |
| SCHEMBL28783847 | 0.74 | MAPT (0.67) | MAPTSMN1; SMN2KDM4EMEN1NPC1 | |
| SCHEMBL6640010 | 0.74 | CA2 (0.47) | MAPTKDM4EMEN1LMNAHPGD | |
| SCHEMBL8178372 | 0.74 | PTPN1 (0.40) | MAPTSMN1; SMN2MEN1NPC1LMNA | |
| SCHEMBL28428524 | 0.73 | ALDH1A1 (0.42) | MAPTKDM4EMEN1NPC1LMNA | |
| SCHEMBL7403541 | 0.73 | PTPN1 (0.41) | MAPTSMN1; SMN2MEN1NPC1LMNA | |
| SCHEMBL27802067 | 0.72 | ALDH1A1 (0.56) | MAPTSMN1; SMN2KDM4EMEN1NPC1 | |
| SCHEMBL23702902 | 0.71 | ACLY (0.51) | ACLY |
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 | disclosed |
| WO-2001047875-A1 | SUBSTITUTED AMINOALKYLAMIDE DERIVATIVES AS ANTAGONISTS OF FOLLICLE STIMULATING HORMONE | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2001-07-05 | — | — | WO | disclosed |