Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.43 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.42 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816300 | 0.92 | BRD4 (0.45) | CYP19A1TP53NPC1MAPTHPGD | |
| SCHEMBL7371809 | 0.92 | PTGER1 (0.46) | CYP19A1TP53NPC1MAPTHPGD | |
| SCHEMBL8813662 | 0.88 | TP53 (0.40) | TP53MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL8816546 | 0.87 | CYP19A1 (0.45) | CYP19A1TP53NPC1MAPTHPGD | |
| SCHEMBL7376652 | 0.86 | PTGER1 (0.46) | CYP19A1NPC1MAPTHPGDRAB9A | |
| SCHEMBL7375499 | 0.85 | MTTP (0.47) | CYP19A1MAPTHPGDSMN1; SMN2ALDH1A1 | |
| SCHEMBL7749370 | 0.82 | CYP19A1 (0.49) | CYP19A1PTGER1GAA | |
| SCHEMBL7375471 | 0.80 | FABP4 (0.41) | NPC1MAPTHPGDRAB9ASMN1; SMN2 | |
| SCHEMBL8813752 | 0.80 | KCNMA1 (0.49) | TP53NPC1MAPTHPGDSMN1; SMN2 | |
| SCHEMBL8812136 | 0.79 | SMN1; SMN2 (0.46) | TP53NPC1MAPTRAB9ASMN1; SMN2 |
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-0757670-A1 | BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-02-12 | — | — | EP | disclosed |