Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 2/20 | 0.44 |
| ▸ | KDM1A | O60341 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6495897 | 0.75 | KDM1A (0.51) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| SCHEMBL4862191 | 0.75 | MEN1 (0.53) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| SCHEMBL6667048 | 0.75 | KDM1A (0.50) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| Hydrochloric Acid SCHEMBL4427642 | 0.74 | KDM1A (0.50) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| SCHEMBL2091146 | 0.72 | KDM1A (0.45) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| SCHEMBL21479899 | 0.71 | MEN1 (0.42) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| SCHEMBL18192167 | 0.69 | SIGMAR1 (0.60) | MEN1KMT2ASIGMAR1TSHRTP53 | |
| SCHEMBL31052615 | 0.69 | SIGMAR1 (0.60) | MEN1KMT2ASIGMAR1TSHRTP53 | |
| SCHEMBL19577941 | 0.68 | KDM1A (0.47) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 | |
| SCHEMBL8745709 | 0.68 | HDAC9 (0.46) | AKR1B1KDM1AMEN1KMT2ASIGMAR1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102245562-B | Process for the synthesis of amino-methyltetralin derivatives | HOFFMANN LA ROCHE | 2014-08-13 | — | — | CN | disclosed |
| CN-101119965-B | Tetralin and indane derivatives and uses thereof | HOFFMANN LA ROCHE | 2012-09-26 | — | — | CN | disclosed |
| CN-102245562-A | Process for the synthesis of amino-methyltetralin derivatives | HOFFMANN LA ROCHE | 2011-11-16 | — | — | CN | disclosed |
| CN-101472884-A | 1 2 3 4-tetralin and indane derivatives and uses thereof | HOFFMANN LA ROCHE (CH) | 2009-07-01 | — | — | CN | disclosed |
| CN-100422181-C | [1,8] naphthyridin-2-ones and related compounds for the treatment of schizophrenia | WARNER LAMBERT CO (US) | 2008-10-01 | — | — | CN | disclosed |
| CN-101119965-A | Tetralin and indane derivatives and uses thereof | ROCHE PALO ALTO LLC (CH) | 2008-02-06 | — | — | CN | disclosed |
| CN-1839134-A | [1,8]naphthyridin-2-ones and related compounds for the treatment of schizophrenia | WARNER LAMBERT CO (US) | 2006-09-27 | — | — | CN | disclosed |