Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | CD44 | P16070 | 1/20 | 0.30 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4593846 | 0.77 | HTR2A (0.33) | PDK2 | |
| SCHEMBL4593434 | 0.73 | TSHR (0.35) | TSHR | |
| SCHEMBL19743353 | 0.72 | PDK2 (0.43) | TSHRACHECYP3A4TDP1PDK2 | |
| SCHEMBL8705403 | 0.69 | TSHR (0.38) | TSHRACHECYP3A4TDP1HDAC4 | |
| SCHEMBL4594159 | 0.69 | ACHE (0.35) | TSHRACHETDP1 | |
| SCHEMBL4593447 | 0.69 | DRD1 (0.32) | — | |
| SCHEMBL4593445 | 0.69 | HDAC4 (0.34) | TSHRACHECYP3A4TDP1HDAC4 | |
| SCHEMBL11470022 | 0.63 | ACHE (0.45) | TSHRACHECYP3A4TDP1HDAC4 | |
| O-Xylene SCHEMBL8518692 | 0.63 | TSHR (0.71) | TSHRACHECYP3A4TDP1 | |
| O-Xylene SCHEMBL6933035 | 0.62 | TSHR (0.83) | TSHRACHECYP3A4TDP1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1937257-A1 | NOVEL ANTIBIOTICS COMPRISING BIS(1-ARYL-5-TETRAZ0LYL)METHANE DERIVATIVES | Nederlandse Organisatie voor toegepast- natuurwetenschappelijk onderzoek TNO (NL) | 2008-07-02 | — | — | EP | disclosed |
| WO-2007037685-A1 | NOVEL ANTIBIOTICS COMPRISING BIS(1-ARYL-5-TETRAZ0LYL)METHANE DERIVATIVES | NEDERLANDSE ORGANISATIE VOOR TOEGEPAST-NATUURWETENSCHAPPELIJK ONDERZOEK TNO (NL) | 2007-04-05 | — | — | WO | disclosed |