Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.45 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.44 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.44 |
| ▸ | PTGER1 | P34995 | 4/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.42 |
| ▸ | MTTP | P55157 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | SENP5 | Q96HI0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816554 | 0.92 | KCNA3 (0.47) | KCNA3KMT2ALRRK2PTGER1AKR1C3 | |
| SCHEMBL7512593 | 0.83 | CYP19A1 (0.45) | KCNA3KMT2AAVPR2AVPR1ALRRK2 | |
| SCHEMBL7370837 | 0.77 | MTTP (0.48) | AVPR2LRRK2PTGER1NPC1MTTP | |
| SCHEMBL7749370 | 0.77 | CYP19A1 (0.49) | AVPR2AVPR1ALRRK2PTGER1GAA | |
| SCHEMBL8816546 | 0.75 | CYP19A1 (0.45) | KCNA3KMT2ALRRK2PTGER1AKR1C3 | |
| SCHEMBL6354409 | 0.75 | NPC1 (0.56) | KMT2APTGER1AKR1C3NPC1RAB9A | |
| SCHEMBL6356805 | 0.74 | KMT2A (0.60) | KMT2APTGER1NPC1RAB9AALDH1A1 | |
| SCHEMBL7371809 | 0.73 | PTGER1 (0.46) | KCNA3PTGER1NPC1RAB9AALDH1A1 | |
| SCHEMBL7509376 | 0.73 | LRRK2 (0.50) | KMT2ALRRK2PTGER1NPC1RAB9A | |
| SCHEMBL8816306 | 0.72 | MAPT (0.48) | KCNA3KMT2ATAS1R3TAS1R1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995029152-A1 | BENZAMIDE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-11-02 | — | — | WO | disclosed |