Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.58 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 4/20 | 0.48 |
| ▸ | PLAU | P00749 | 1/20 | 0.48 |
| ▸ | PLAT | P00750 | 1/20 | 0.48 |
| ▸ | F2 | P00734 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL15955987 | 0.78 | TRPM8 (0.70) | HTR1ALTA4H | |
| SCHEMBL3248265 | 0.77 | MTNR1A (0.66) | MTNR1AMTNR1BAKR1B1 | |
| SCHEMBL15956138 | 0.76 | TRPM8 (0.57) | ABCB1SMN1; SMN2ALDH1A1HPGDHTR1A | |
| SCHEMBL17188139 | 0.75 | ALOX5 (0.56) | ALOX5CYP3A4MTNR1AMTNR1BPLAU | |
| SCHEMBL27660097 | 0.75 | ALOX5 (0.56) | ALOX5CYP3A4MTNR1AMTNR1BPLAU | |
| SCHEMBL13097042 | 0.74 | LTA4H (0.61) | ABCB1F2KCNH2GRIN2BSMN1; SMN2 | |
| SCHEMBL4489367 | 0.74 | MRGPRX4 (0.50) | ALOX5CYP3A4PLAUPLATSMN1; SMN2 | |
| SCHEMBL10606515 | 0.74 | ALOX5 (0.67) | ALOX5CYP3A4MTNR1APLAUPLAT | |
| SCHEMBL8783402 | 0.73 | F2 (0.63) | ABCB1F2KCNH2GRIN2BSMN1; SMN2 | |
| SCHEMBL29227079 | 0.73 | ABCB1 (0.58) | ABCB1SMN1; SMN2ALDH1A1CYP1A2CYP2D6 |
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-100455579-C | Compounds and compositions as protein kinase inhibitors | IRM LLC (BM) | 2009-01-28 | — | — | CN | disclosed |
| CN-1860111-A | Compounds and compositions as protein kinase inhibitors | IRM LLC (BM) | 2006-11-08 | — | — | CN | disclosed |