Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 5/20 | 0.75 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.74 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.66 |
| ▸ | TUBB | P07437 | 1/20 | 0.66 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.66 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.66 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.66 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.66 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.66 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.66 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.66 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.66 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.66 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.66 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.66 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.66 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.66 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.63 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.59 |
| ▸ | MAOB | P27338 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL834551 | 0.88 | TAAR1 (0.73) | CALM1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL9491787 | 0.88 | CYP19A1 (0.68) | CALM1CYP19A1TUBB4ATUBBTUBA3C | |
| SCHEMBL27254011 | 0.86 | CALM1 (1.00) | CALM1CYP19A1TUBB4ATUBBTUBA3C | |
| SCHEMBL4735081 | 0.85 | CALM1 (0.73) | CALM1CYP19A1AKR1B1 | |
| SCHEMBL10384348 | 0.85 | CYP19A1 (1.00) | CALM1CYP19A1TUBB4ATUBBTUBA3C | |
| SCHEMBL1972535 | 0.84 | CYP19A1 (0.66) | CALM1CYP19A1AKR1B1TAAR1MAOB | |
| Hydrochloric Acid SCHEMBL9827015 | 0.84 | CYP19A1 (0.96) | CALM1CYP19A1TUBB4ATUBBTUBA3C | |
| SCHEMBL10450398 | 0.81 | TAAR1 (0.64) | CALM1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL30514717 | 0.81 | CALM1 (0.86) | CALM1TUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL4949653 | 0.81 | TAAR1 (0.67) | CALM1TAAR1MAOBIDO1SIGMAR1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115772058-B | Reduction method of aromatic internal olefins | 南通大学 | 2024-08-16 | — | — | CN | disclosed |
| CN-115197114-B | Aromatic selenocyanum compound and green synthesis method and application thereof | 南宁师范大学 | 2023-09-05 | — | — | CN | disclosed |
| CN-115772058-A | Reduction method of aromatic internal olefin | 南通大学 | 2023-03-10 | — | — | CN | disclosed |
| CN-115197114-A | Aromatic selenium cyanogen ester compound and green synthesis method and application thereof | 南宁师范大学 | 2022-10-18 | — | — | CN | disclosed |