Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9852738 | 0.86 | CYP3A4 (0.48) | CYP3A4ALDH1A1KMT2APOLBKDM4E | |
| SCHEMBL8803730 | 0.86 | KMT2A (0.46) | CYP3A4ALDH1A1KMT2APOLBKDM4E | |
| SCHEMBL17030439 | 0.85 | CYP3A4 (0.53) | CYP3A4ALDH1A1KMT2APOLBCYP2C9 | |
| SCHEMBL8804310 | 0.83 | KMT2A (0.46) | CYP3A4ALDH1A1KMT2APOLBKDM4E | |
| SCHEMBL18077304 | 0.82 | KMT2A (0.51) | CYP3A4ALDH1A1KMT2APOLBCYP2C9 | |
| SCHEMBL11168166 | 0.82 | KMT2A (0.48) | CYP3A4ALDH1A1KMT2APOLBKDM4E | |
| SCHEMBL8057057 | 0.82 | CYP3A4 (0.59) | CYP3A4ALDH1A1KMT2APOLBCYP2C9 | |
| SCHEMBL10807398 | 0.82 | KMT2A (0.45) | CYP3A4ALDH1A1KMT2APOLBKDM4E | |
| SCHEMBL9664313 | 0.81 | CYP3A4 (0.47) | CYP3A4ALDH1A1KMT2APOLBKDM4E | |
| SCHEMBL10811592 | 0.81 | CYP3A4 (0.43) | CYP3A4ALDH1A1KMT2APOLBKDM4E |
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-0430149-A2 | Pharmaceutical preparations | Heinrich Mack Nachf. (DE) | 1991-06-05 | — | — | EP | claimed |
| EP-0430149-A2 | Pharmaceutical preparations | Heinrich Mack Nachf. (DE) | 1991-06-05 | — | — | EP | disclosed |