Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.70 |
| ▸ | MEN1 | O00255 | 3/20 | 0.67 |
| ▸ | GRM4 | Q14833 | 8/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.66 |
| ▸ | MAPT | P10636 | 5/20 | 0.66 |
| ▸ | NPC1 | O15118 | 4/20 | 0.66 |
| ▸ | RAB9A | P51151 | 4/20 | 0.66 |
| ▸ | HPGD | P15428 | 1/20 | 0.66 |
| ▸ | HTT | P42858 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.63 |
| ▸ | USP2 | O75604 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL195970 | 0.91 | SMN1; SMN2 (0.78) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL11691716 | 0.88 | ALDH1A1 (0.65) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL11313551 | 0.88 | KDM4E (0.62) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL12181724 | 0.88 | ALDH1A1 (0.65) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL12189396 | 0.84 | KMT2A (0.69) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL23202525 | 0.83 | KMT2A (0.67) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL28568665 | 0.83 | PTGS2 (0.55) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL15164883 | 0.82 | HTT (0.74) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL10520535 | 0.82 | METAP2 (0.68) | PTGS2KMT2AALDH1A1KDM4EMEN1 | |
| SCHEMBL31078090 | 0.81 | RORC (0.61) | PTGS2KMT2AALDH1A1KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1638556-B1 | 2-AMINOBENZOTHIAZOLES AS CB1 RECEPTOR INVERSE AGONISTS | HOFFMANN LA ROCHE (CH) | 2008-04-02 | — | — | EP | claimed |