Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 16/20 | 0.49 |
| ▸ | HTR1D | P28221 | 16/20 | 0.49 |
| ▸ | HTR1B | P28222 | 16/20 | 0.49 |
| ▸ | DRD2 | P14416 | 5/20 | 0.49 |
| ▸ | HTR7 | P34969 | 5/20 | 0.49 |
| ▸ | DRD3 | P35462 | 5/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.49 |
| ▸ | HTR6 | P50406 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 4/20 | 0.47 |
| ▸ | HTR2C | P28335 | 4/20 | 0.47 |
| ▸ | HTR2B | P41595 | 4/20 | 0.47 |
| ▸ | F13A1 | P00488 | 1/20 | 0.46 |
| ▸ | TGM2 | P21980 | 1/20 | 0.46 |
| ▸ | TGM1 | P22735 | 1/20 | 0.46 |
| ▸ | TGM3 | Q08188 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1877511 | 0.82 | F13A1 (0.70) | F13A1TGM2TGM1TGM3 | |
| SCHEMBL4178112 | 0.71 | NCF1 (0.59) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL6901428 | 0.70 | LMNA (0.48) | F13A1TGM2TGM1TGM3 | |
| SCHEMBL6901071 | 0.69 | TGM2 (0.59) | F13A1TGM2TGM1TGM3 | |
| SCHEMBL6902507 | 0.68 | TGM2 (0.65) | F13A1TGM2TGM1TGM3 | |
| SCHEMBL13525141 | 0.68 | CYP2C9 (0.67) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL10516997 | 0.68 | NCF1 (0.65) | HTR1AHTR1DHTR1BDRD2HTR7 | |
| SCHEMBL6899848 | 0.67 | TGM2 (0.62) | F13A1TGM2TGM1TGM3 | |
| SCHEMBL6900651 | 0.67 | MEN1 (0.48) | HTR2CF13A1TGM2TGM1TGM3 | |
| SCHEMBL28139077 | 0.67 | NCF1 (0.68) | HTR1AHTR1DHTR1BKCNH2CYP2C9 |
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-2011060321-A1 | TRANSGLUTAMINASE TG2 INHIBITORS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE THEREOF | CHDI, INC. (US) | 2011-05-19 | — | — | WO | disclosed |