Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | PKM | P14618 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 7/20 | 0.39 |
| ▸ | BCHE | P06276 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9195367 | 0.77 | KDM4E (0.54) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL8209185 | 0.70 | KDM4E (0.74) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL29479235 | 0.70 | KDM4E (0.74) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL30617062 | 0.70 | MAPT (1.00) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL5264214 | 0.70 | MAPT (1.00) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL4698146 | 0.70 | ANPEP (0.36) | KDM4EALDH1A1 | |
| SCHEMBL4748664 | 0.69 | HTR2A (0.58) | ACHE | |
| SCHEMBL28693031 | 0.68 | ALDH1A1 (0.66) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL29993094 | 0.68 | KDM4E (0.70) | CYP3A4CYP2C9CYP2C19KDM4EMAPT | |
| SCHEMBL24349374 | 0.67 | MAPT (0.64) | CYP3A4CYP2C9CYP2C19KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6130228-A | Polycyclic compounds | UNIVERSITY OF STRATHCLYDE (GB) | 2000-10-10 | — | — | US | disclosed |