Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.59 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TRPV6 | Q9H1D0 | 2/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.48 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2037248 | 1.00 | CHRNB2 (0.59) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| Hydrochloric Acid SCHEMBL8052496 | 0.98 | CHRNB2 (0.58) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| SCHEMBL27196354 | 0.91 | CHRNB2 (0.65) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| SCHEMBL13850152 | 0.91 | CHRNB2 (0.65) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| SCHEMBL5015324 | 0.91 | CHRNB2 (0.68) | CHRNB2CHRNA4ALDH1A1KDM4ETRPV6 | |
| Hydrochloric Acid SCHEMBL61401 | 0.89 | CHRNB2 (0.66) | CHRNB2CHRNA4ALDH1A1KDM4ETRPV6 | |
| SCHEMBL938061 | 0.86 | CHRNB2 (0.61) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| SCHEMBL6399377 | 0.82 | CHRNB2 (0.59) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| SCHEMBL6398126 | 0.82 | CHRNB2 (0.59) | CHRNB2CHRNA4ALDH1A1MAPTHTT | |
| SCHEMBL14197746 | 0.82 | CHRNB2 (0.59) | CHRNB2CHRNA4ALDH1A1MAPTHTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6562964-B1 | Inhibitors of rotamase enzymes in particular FKBP-12 and FKBP-52. The compounds therefore moderate neuronal regeneration and outgrowth and can be used for treating neurological disorders arising from neurodegenerative diseases or other disorders | PFIZER INC | 2003-05-13 | — | — | US | disclosed |
| EP-1100797-B1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ROTAMASE ENZYMES | PFIZER LTD (GB) | 2003-02-26 | — | — | EP | disclosed |
| US-6372736-B1 | ENZYME INHIBITORS | PFIZER INC | 2002-04-16 | — | — | US | disclosed |
| EP-1100797-A1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ROTAMASE ENZYMES | Pfizer Limited (GB) | 2001-05-23 | — | — | EP | disclosed |
| WO-2000005232-A1 | HETEROCYCLIC COMPOUNDS AS INHIBITORS OF ROTAMASE ENZYMES | PFIZER LIMITED (GB) | 2000-02-03 | — | — | WO | disclosed |