Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 2/20 | 0.51 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.44 |
| ▸ | WNT3A | P56704 | 3/20 | 0.44 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.43 |
| ▸ | TUBB | P07437 | 1/20 | 0.43 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.43 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.43 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.43 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.43 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.43 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.43 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.43 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1222893 | 0.84 | MAOA (0.67) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL31094660 | 0.84 | MAOA (0.67) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| Hydrochloric Acid SCHEMBL28263903 | 0.83 | MAOA (0.65) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL6874059 | 0.81 | MAOA (0.50) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL1675118 | 0.78 | CA12 (0.53) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL27752787 | 0.76 | TAS1R3 (0.50) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL7493251 | 0.76 | TAS1R3 (0.46) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL8132038 | 0.75 | TAS1R3 (0.57) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL27752783 | 0.75 | CTNNB1 (0.49) | MAOATAS1R3TAS1R1MAPTCYP1A2 | |
| SCHEMBL9034535 | 0.74 | MAOA (0.50) | MAOATAS1R3TAS1R1MAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010093191-A2 | NOVEL COMPOUNDS EFFECTIVE AS XANTHINE OXIDASE INHIBITORS, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | LG LIFE SCIENCES LTD. (KR) | 2010-08-19 | — | — | WO | disclosed |
| WO-2010093191-A2 | NOVEL COMPOUNDS EFFECTIVE AS XANTHINE OXIDASE INHIBITORS, METHOD FOR PREPARING THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME | LG LIFE SCIENCES LTD. (KR) | 2010-08-19 | — | — | WO | disclosed |