Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.35 |
| ▸ | TACR2 | P21452 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SHBG | P04278 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL3806604 | 0.98 | KCNH2 (0.41) | KCNH2CNR1CNR2PTGS2GPR84 | |
| SCHEMBL1321965 | 0.91 | KMT2A (0.39) | KCNH2CNR1CNR2GPR84ALDH1A1 | |
| SCHEMBL11763467 | 0.86 | HTT (0.39) | KCNH2CNR1CNR2PTGS2GPR84 | |
| SCHEMBL1318031 | 0.82 | KDM4E (0.39) | ALDH1A1PKMHPGDKDM4ETP53 | |
| SCHEMBL3281802 | 0.80 | HTT (0.40) | CNR1CNR2ALDH1A1HPGDLMNA | |
| SCHEMBL29523323 | 0.79 | KCNH2 (0.50) | KCNH2PTGS2GPR84CYP3A4ALDH1A1 | |
| SCHEMBL7711334 | 0.79 | KCNH2 (0.50) | KCNH2PTGS2GPR84CYP3A4ALDH1A1 | |
| SCHEMBL31054446 | 0.79 | KCNH2 (0.50) | KCNH2PTGS2GPR84CYP3A4ALDH1A1 | |
| SCHEMBL811827 | 0.79 | PTGS2 (0.53) | KCNH2PTGS2GPR84CYP3A4ALDH1A1 | |
| SCHEMBL5747863 | 0.79 | PTGS2 (0.53) | KCNH2PTGS2GPR84CYP3A4ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0565488-B1 | Fluorine free titanocenes and their application | CIBA GEIGY AG (CH) | 1999-04-21 | — | — | EP | disclosed |
| US-5340701-A | Photoinitiators | CIBA-GEIGY CORPORATION (US) | 1994-08-23 | — | — | US | disclosed |
| EP-0565488-A1 | Fluorine free titanocenes and their application | CIBA-GEIGY AG (CH) | 1993-10-13 | — | — | EP | disclosed |