Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | IDO1 | P14902 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MLKL | Q8NB16 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21788562 | 1.00 | TAAR1 (0.57) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL630978 | 0.88 | TAAR1 (0.63) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL17910629 | 0.86 | RAB9A (0.58) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL17910625 | 0.86 | TAAR1 (0.57) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL17910928 | 0.86 | KMT2A (0.66) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL17910326 | 0.86 | TAAR1 (0.57) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL16447884 | 0.84 | RAB9A (0.60) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL17910498 | 0.84 | RAB9A (0.60) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| Hydrochloric Acid SCHEMBL17910586 | 0.84 | TAAR1 (0.56) | TAAR1IDO1KMT2ACYP2D6CYP2C9 | |
| SCHEMBL17910846 | 0.83 | ALDH1A1 (0.56) | TAAR1IDO1KMT2ACYP2D6CYP2C9 |
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-112209991-B | Tripeptide inhibitor of APC/Asef interaction and application thereof | 上海交通大学医学院 | 2022-08-12 | — | — | CN | claimed |
| CN-112209991-B | Tripeptide inhibitor of APC/Asef interaction and application thereof | 上海交通大学医学院 | 2022-08-12 | — | — | CN | disclosed |