Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.48 |
| ▸ | MT-ND4 | P03905 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | USP2 | O75604 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | GMNN | O75496 | 1/20 | 0.48 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL13248245 | 0.94 | CYP3A4 (0.54) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL13056524 | 0.90 | CYP3A4 (0.51) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL13248251 | 0.84 | CYP3A4 (0.47) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL10133744 | 0.84 | CYP3A4 (0.59) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL2631491 | 0.83 | CYP3A4 (0.58) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL12197705 | 0.82 | CYP3A4 (0.54) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL13056513 | 0.81 | CYP3A4 (0.58) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL19828217 | 0.80 | CYP3A4 (0.54) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL19721743 | 0.79 | CYP3A4 (0.43) | CYP3A4MAPTALDH1A1KDM4ELMNA | |
| SCHEMBL13248243 | 0.79 | CYP3A4 (0.52) | CYP3A4MAPTALDH1A1KDM4ELMNA |
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-9719986-B2 | Haptens, hapten conjugates, compositions thereof preparation and method for their preparation and use | VENTANA MEDICAL SYSTEMS, INC. (US) | 2017-08-01 | — | — | US | disclosed |
| US-20140323336-A1 | HAPTENS, HAPTEN CONJUGATES, COMPOSITIONS THEREOF AND METHOD FOR THEIR PREPARATION AND USE | VENTANA MEDICAL SYSTEMS, INC. (US) | 2014-10-30 | — | — | US | disclosed |