Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | CCR8 | P51685 | 1/20 | 0.32 |
| ▸ | METAP1 | P53582 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.32 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14908528 | 0.73 | KDM4E (0.44) | KDM4ELMNACYP1A2POLBCCR1 | |
| SCHEMBL15602609 | 0.73 | KDM4E (0.37) | KDM4ELMNACYP1A2POLBCCR1 | |
| SCHEMBL452905 | 0.69 | — | — | |
| SCHEMBL13966618 | 0.67 | KDM4E (0.38) | KDM4ELMNACYP1A2POLBCCR1 | |
| SCHEMBL13976103 | 0.67 | CYP2D6 (0.41) | KDM4ELMNACYP1A2POLBCCR1 | |
| SCHEMBL6202926 | 0.66 | KDM4E (0.41) | KDM4ELMNACYP1A2POLBCCR1 | |
| SCHEMBL2631576 | 0.64 | NPC1 (0.62) | KDM4EMEN1NPC1RAB9AKMT2A | |
| SCHEMBL29232611 | 0.63 | NPC1 (0.40) | KDM4ELMNACYP1A2POLBCCR1 | |
| SCHEMBL7013251 | 0.63 | KDM4E (0.46) | KDM4ELMNACYP1A2POLBCCR1 | |
| Hydrochloric Acid SCHEMBL10488703 | 0.63 | KDM4E (0.46) | KDM4ELMNACYP1A2POLBCCR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2670764-B1 | C-28 AMINES OF C-3 MODIFIED BETULINIC ACID DERIVATIVES AS HIV MATURATION INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2015-09-02 | — | — | EP | disclosed |