Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.46 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.46 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.46 |
| ▸ | TUBB | P07437 | 1/20 | 0.46 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.46 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.46 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.46 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.46 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.46 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.46 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.46 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.46 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.46 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.46 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.46 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.46 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1675118 | 0.84 | CA12 (0.53) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL27752787 | 0.80 | TAS1R3 (0.50) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL6874334 | 0.76 | TAS1R3 (0.45) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL103794 | 0.76 | TUBB4A (0.58) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL29377304 | 0.76 | TUBB4A (0.58) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| Hydrochloric Acid SCHEMBL28263909 | 0.75 | TUBB4A (0.57) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| Ammonia Solution, Strong SCHEMBL28339305 | 0.75 | TUBB4A (0.57) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL8132038 | 0.75 | TAS1R3 (0.57) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL27752783 | 0.75 | CTNNB1 (0.49) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C | |
| SCHEMBL6874059 | 0.74 | MAOA (0.50) | TAS1R3TAS1R1TUBB4ATUBBTUBA3C |
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 |
|---|---|---|---|---|---|---|---|
| CN-102358741-A | Azepinoindole derivatives as pharmaceutical agents | EXELIXIS INC | 2012-02-22 | — | — | CN | disclosed |
| CN-1914207-A | Aza * -indoline derivatives as medicaments | EXELIXIS INC (US) | 2007-02-14 | — | — | CN | disclosed |