Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 15/20 | 0.56 |
| ▸ | RARG | P13631 | 13/20 | 0.56 |
| ▸ | RARA | P10276 | 11/20 | 0.56 |
| ▸ | RARB | P10826 | 11/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.56 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | GMNN | O75496 | 1/20 | 0.56 |
| ▸ | USP2 | O75604 | 1/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | THPO | P40225 | 1/20 | 0.56 |
| ▸ | MTOR | P42345 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8924453 | 1.00 | RXRA (0.56) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL10976577 | 0.78 | RXRA (0.60) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL10975732 | 0.78 | RXRA (0.60) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL10976582 | 0.78 | RXRA (0.60) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL8361328 | 0.78 | RARG (0.59) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL8361324 | 0.78 | RARG (0.59) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL8361327 | 0.78 | RARG (0.59) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL8183716 | 0.76 | RXRA (0.66) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL7876468 | 0.76 | RXRA (0.66) | RXRARARGRARARARBCYP3A4 | |
| SCHEMBL6958780 | 0.76 | RXRA (0.66) | RXRARARGRARARARBCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0802897-A1 | NOVEL COMPOUNDS | Smithkline Beecham S.p.A. (IT) | 1997-10-29 | — | — | EP | disclosed |
| WO-1996021638-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM S.P.A. (IT) | 1996-07-18 | — | — | WO | disclosed |