Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.41 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.41 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1571975 | 0.86 | TSHR (0.52) | TSHRSLC1A3SLC1A2SLC1A1KMT2A | |
| SCHEMBL9109325 | 0.83 | TRPA1 (0.40) | TSHRSLC1A3SLC1A2SLC1A1KMT2A | |
| SCHEMBL27261214 | 0.81 | TSHR (0.45) | TSHRSLC1A3SLC1A2SLC1A1KMT2A | |
| SCHEMBL3275844 | 0.81 | TSHR (0.45) | TSHRSLC1A3SLC1A2SLC1A1KMT2A | |
| SCHEMBL10967301 | 0.81 | TSHR (0.45) | TSHRSLC1A3SLC1A2SLC1A1KMT2A | |
| SCHEMBL14285713 | 0.81 | CYP1A2 (0.52) | TSHRSLC1A3SLC1A2SLC1A1KMT2A | |
| SCHEMBL21068714 | 0.81 | TSHR (0.45) | TSHRKMT2AALDH1A1RCE1TRPA1 | |
| SCHEMBL21068518 | 0.81 | TSHR (0.45) | TSHRKMT2AALDH1A1RCE1TRPA1 | |
| SCHEMBL21068517 | 0.81 | TSHR (0.45) | TSHRKMT2AALDH1A1RCE1TRPA1 | |
| SCHEMBL27131173 | 0.81 | CA1 (0.47) | TSHRSLC1A1KMT2ACA1CA2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0859610-B1 | IBOGAMINE CONGENERS | ALBANY MEDICAL COLLEGE (US) | 2006-01-11 | — | — | EP | disclosed |
| EP-0859610-A4 | IBOGAMINE CONGENERS | ALBANY MEDICAL COLLEGE (US) | 2002-05-15 | — | — | EP | disclosed |
| US-6211360-B1 | DRUG ABRUSE THERAPY; PLANT EXTRACTS | ALBANY MEDICAL COLLEGE | 2001-04-03 | — | — | US | disclosed |
| EP-0859610-A1 | IBOGAMINE CONGENERS | ALBANY MEDICAL COLLEGE (US) | 1998-08-26 | — | — | EP | disclosed |
| WO-1997005869-A1 | IBOGAMINE CONGENERS | ALBANY MEDICAL COLLEGE (US) | 1997-02-20 | — | — | WO | disclosed |