Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | XBP1 | P17861 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14743979 | 0.89 | TSHR (0.42) | TSHRRAB9AMAPTNPC1ATM | |
| SCHEMBL14743719 | 0.86 | ALDH1A1 (0.42) | TSHRALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL14743702 | 0.86 | TPMT (0.40) | TSHRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL14743684 | 0.85 | TSHR (0.38) | TSHRRAB9AMAPTNPC1ATM | |
| SCHEMBL14743102 | 0.84 | TSHR (0.38) | TSHRRAB9AMAPTNPC1ATM | |
| SCHEMBL14743067 | 0.84 | ALDH1A1 (0.43) | TSHRRAB9AMAPTNPC1ALDH1A1 | |
| SCHEMBL14743329 | 0.80 | NPC1 (0.45) | TSHRRAB9ANPC1MEN1KMT2A | |
| SCHEMBL14743756 | 0.79 | GPBAR1 (0.46) | KDM4EKMT2AACLYL3MBTL1 | |
| SCHEMBL14743613 | 0.79 | SENP1 (0.44) | RAB9AMAPTNPC1ATMPLAU | |
| SCHEMBL14743539 | 0.79 | PTGES (0.48) | TSHRRAB9ANPC1HPGDSMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013030358-A1 | GLYCINE B ANTAGONISTS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2013-03-07 | — | — | WO | disclosed |