Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.45 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 2/20 | 0.38 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | RHEB | Q15382 | 1/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7200528 | 0.74 | NR1H2 (0.56) | NOTUMCA12CA1CA2CA9 | |
| SCHEMBL657644 | 0.74 | NR1H2 (0.61) | — | |
| SCHEMBL17279701 | 0.73 | NR1H2 (0.71) | ABCG2 | |
| SCHEMBL2479265 | 0.72 | MMP3 (0.52) | NOTUMMMP3GAACYP11B2KIF11 | |
| SCHEMBL4865340 | 0.72 | JAK2 (0.49) | ABCG2 | |
| SCHEMBL2485799 | 0.70 | XDH (0.49) | NOTUMGAA | |
| SCHEMBL26246 | 0.69 | MMP3 (0.74) | NOTUMMMP3CYP11B2KIF11CA12 | |
| SCHEMBL13063633 | 0.69 | MMP3 (0.74) | NOTUMMMP3CYP11B2KIF11CA12 | |
| SCHEMBL396846 | 0.69 | MMP3 (0.74) | NOTUMMMP3CYP11B2KIF11CA12 | |
| Water SCHEMBL11055485 | 0.69 | MMP3 (0.74) | NOTUMMMP3CYP11B2KIF11CA12 |
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 |
|---|---|---|---|---|---|---|---|
| US-5463071-A | Tetrazole derivatives; useful for inhibiting undesirable cell aggregation | DR. KARL THOMAE GMBH (DE) | 1995-10-31 | — | — | US | disclosed |
| EP-0525629-A2 | 5-membered heterocycles, process for their preparation and medicaments containing them | Dr. Karl Thomae GmbH (DE) | 1993-02-03 | — | — | EP | disclosed |