Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | CCR3 | P51677 | 1/20 | 0.56 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.54 |
| ▸ | ABL1 | P00519 | 1/20 | 0.54 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | DRD4 | P21917 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | PHGDH | O43175 | 1/20 | 0.53 |
| ▸ | MGLL | Q99685 | 1/20 | 0.53 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8688396 | 0.90 | S1PR5 (0.54) | KMT2AMEN1TSHRACHECCR3 | |
| Hydrochloric Acid SCHEMBL8687746 | 0.89 | S1PR5 (0.53) | KMT2AMEN1TSHRACHECCR3 | |
| SCHEMBL1135840 | 0.83 | MEN1 (0.57) | KMT2AMEN1TSHRACHECCR3 | |
| SCHEMBL518686 | 0.83 | NPC1 (0.71) | KMT2AMEN1TSHRABL1RIN1 | |
| Hydrochloric Acid SCHEMBL310978 | 0.82 | MEN1 (0.56) | KMT2AMEN1TSHRACHECCR3 | |
| Hydrochloric Acid SCHEMBL5712502 | 0.82 | NPC1 (0.70) | KMT2AMEN1TSHRABL1RIN1 | |
| SCHEMBL30447325 | 0.80 | GAA (0.63) | KMT2AMEN1TSHRKCNH2ALDH1A1 | |
| SCHEMBL3325622 | 0.80 | ALDH1A1 (0.68) | KMT2AMEN1ACHESIGMAR1KCNH2 | |
| SCHEMBL1519223 | 0.79 | MEN1 (0.69) | KMT2AMEN1TSHRACHESIGMAR1 | |
| SCHEMBL27608094 | 0.79 | MEN1 (0.69) | KMT2AMEN1TSHRACHECCR3 |
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-1742934-A2 | PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR CCR5 | AstraZeneca AB (SE) | 2007-01-17 | — | — | EP | disclosed |
| WO-2005101989-A2 | PIPERIDINE DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR CCR5 | ASTRAZENECA AB (SE) | 2005-11-03 | — | — | WO | disclosed |