Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL531667 | 0.82 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL1570497 | 0.81 | TAAR1 (0.52) | ALOX15HSD17B10CRHBPCRHR2KMT2A | |
| SCHEMBL13477055 | 0.81 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL29673153 | 0.81 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL10122957 | 0.81 | CYP2C19 (0.43) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL17552727 | 0.81 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL3121724 | 0.81 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL4098463 | 0.81 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL30515548 | 0.80 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 | |
| SCHEMBL20399857 | 0.80 | ALDH1A1 (0.43) | ALDH1A1SMN1; SMN2RAB9ACYP1A2CYP2C19 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3297989-A1 | SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF | Genentech, Inc. (US) | 2018-03-28 | — | — | EP | disclosed |
| WO-2016191312-A1 | SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF | GENENTECH, INC. (US) | 2016-12-01 | — | — | WO | disclosed |
| CN-101318943-A | Substituted piperazine compounds, preparation method and application thereof, and pharmaceutical composition containing compounds | SHANGHAI INST MATERIA MEDICA (CN) | 2008-12-10 | — | — | CN | disclosed |