Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 4/20 | 0.48 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8717429 | 0.84 | CA9 (0.35) | CA9LMNACA12CA1CA7 | |
| SCHEMBL30676839 | 0.77 | NCEH1 (0.65) | CA9NCEH1LMNACYP3A4SMN1; SMN2 | |
| SCHEMBL3357585 | 0.77 | NCEH1 (0.65) | CA9NCEH1LMNACYP3A4SMN1; SMN2 | |
| SCHEMBL9739745 | 0.75 | MAPT (0.40) | MAPK1LMNACYP3A4MAPTKDM4E | |
| SCHEMBL9164412 | 0.75 | MAPT (0.36) | NCEH1GAAMAPTKDM4EALDH1A1 | |
| SCHEMBL15410676 | 0.74 | ALDH1A1 (0.36) | MAPK1LMNACYP3A4SMN1; SMN2MAPT | |
| SCHEMBL4326638 | 0.73 | CYP19A1 (0.41) | NCEH1CYP3A4SMN1; SMN2MAPTMEN1 | |
| SCHEMBL8722679 | 0.73 | MAPT (0.35) | NCEH1MAPTHPGD | |
| SCHEMBL8556354 | 0.73 | MAPT (0.35) | CYP3A4MAPT | |
| SCHEMBL4465114 | 0.73 | CYP19A1 (0.41) | NCEH1MAPK1LMNASMN1; SMN2MAPT |
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-5763455-A | SEROTONIN RECEPTOR ANTAGONISTS | WAKE FOREST UNIVERSITY (US) | 1998-06-09 | — | — | US | disclosed |
| US-5760055-A | PSYCHOLOGICAL AND NERVOUS SYSTEM DISORDERS | WAKE FOREST UNIVERSITY (US) | 1998-06-02 | — | — | US | disclosed |