Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.40 |
| ▸ | PIM1 | P11309 | 4/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | TTK | P33981 | 1/20 | 0.34 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30796270 | 1.00 | KDM4E (0.44) | KDM4EMAPTPIM2PIM1KDM1A | |
| SCHEMBL730405 | 0.86 | CCR1 (0.42) | KDM4ECYP2A6ALDH1A1CCR1CCR5 | |
| SCHEMBL29387096 | 0.86 | CCR1 (0.42) | KDM4ECYP2A6ALDH1A1CCR1CCR5 | |
| SCHEMBL30259554 | 0.84 | CCR1 (0.41) | KDM4EKDM1ACYP2A6ALDH1A1CCR1 | |
| SCHEMBL30259309 | 0.84 | CCR1 (0.41) | KDM4EKDM1ACYP2A6ALDH1A1CCR1 | |
| SCHEMBL19385092 | 0.79 | CYP2A6 (0.60) | PIM2PIM1KDM1AHDAC1HDAC6 | |
| SCHEMBL17057411 | 0.79 | CYP2A6 (0.37) | KDM4ECYP2A6ALDH1A1CCR1CCR5 | |
| SCHEMBL30541407 | 0.77 | PIM2 (0.65) | KDM4EMAPTPIM2PIM1TTK | |
| SCHEMBL1313677 | 0.77 | PIM2 (0.65) | KDM4EMAPTPIM2PIM1TTK | |
| SCHEMBL23787847 | 0.77 | KDM4E (0.42) | KDM4EKDM1AHDAC1HDAC6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010124055-A1 | 2-ALKYL PIPERIDINE MGLUR5 RECEPTOR MODULATORS | MERCK SHARP & DOHME CORP. (US) | 2010-10-28 | — | — | WO | claimed |