Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.31 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CCR8 | P51685 | 1/20 | 0.31 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4410339 | 0.93 | MAOB (0.34) | ALDH1A1KDM4EKMT2AMCHR1TDP1 | |
| Hydrochloric Acid SCHEMBL4400750 | 0.92 | SMN1; SMN2 (0.32) | ALDH1A1KDM4ETDP1TSHRHTT | |
| Hydrochloric Acid SCHEMBL4398625 | 0.92 | TDP1 (0.37) | ALDH1A1KDM4EMCHR1TDP1MAOB | |
| Hydrochloric Acid SCHEMBL4397030 | 0.90 | DRD2 (0.35) | ALDH1A1KDM4ETDP1MAOBTSHR | |
| SCHEMBL4411259 | 0.90 | MAOB (0.40) | ALDH1A1KMT2AMCHR1MAOB | |
| Hydrochloric Acid SCHEMBL4406706 | 0.90 | ALDH1A1 (0.34) | ALDH1A1KDM4EKMT2AMCHR1TDP1 | |
| SCHEMBL914437 | 0.90 | KMT2A (0.41) | ALDH1A1KDM4EKMT2AMAOB | |
| Hydrochloric Acid SCHEMBL4406718 | 0.89 | ALDH1A1 (0.32) | ALDH1A1KDM4ETDP1MAOBTSHR | |
| Hydrochloric Acid SCHEMBL4396994 | 0.88 | SMN1; SMN2 (0.31) | ALDH1A1MCHR1TDP1TSHRHTT | |
| Hydrochloric Acid SCHEMBL4405568 | 0.88 | ALDH1A1 (0.37) | ALDH1A1KDM4ETDP1MAOBTSHR |
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-1720859-B1 | CHEMOKINE RECEPTOR ANTAGONISTS | NOVARTIS AG (CH) | 2009-12-23 | — | — | EP | claimed |