Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28618843 | 0.89 | KDM4E (0.56) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL8347823 | 0.85 | CTSS (0.57) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL6825413 | 0.82 | MAPT (0.60) | TSHRTDP1ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL3860229 | 0.81 | TSHR (0.66) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL6727015 | 0.81 | CYP1A2 (0.53) | ALDH1A1HPGDKMT2AGAASMN1; SMN2 | |
| SCHEMBL6715728 | 0.80 | TSHR (0.60) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL28304178 | 0.80 | TSHR (0.60) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL6717094 | 0.79 | ALDH1A1 (0.51) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL10362776 | 0.79 | KDM4E (0.73) | TSHRTDP1KDM4EALDH1A1HPGD | |
| SCHEMBL6715736 | 0.79 | ALDH1A1 (0.60) | TSHRTDP1KDM4EALDH1A1HPGD |
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-2004022534-A1 | ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS | NPS ALLELIX CORP. (CA) | 2004-03-18 | — | — | WO | disclosed |