Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.47 |
| ▸ | CCR5 | P51681 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL668624 | 0.85 | ABCB1 (0.52) | RAB9AMEN1KMT2AALDH1A1MCHR1 | |
| SCHEMBL7067262 | 0.84 | SIGMAR1 (0.55) | MCHR1HTR2ALTA4HCCR5SIGMAR1 | |
| SCHEMBL24008595 | 0.80 | RAB9A (0.72) | RAB9ANPC1MEN1KMT2AALDH1A1 | |
| SCHEMBL4141085 | 0.77 | ALDH1A1 (0.60) | RAB9ANPC1MEN1KMT2AALDH1A1 | |
| SCHEMBL24008985 | 0.76 | RAB9A (0.64) | RAB9ANPC1MEN1KMT2AALDH1A1 | |
| SCHEMBL668374 | 0.75 | PDE4B (0.61) | LMNAMEN1KMT2ABCHEACHE | |
| SCHEMBL669902 | 0.74 | MEN1 (0.58) | RAB9AMEN1KMT2AALDH1A1MCHR1 | |
| SCHEMBL5163291 | 0.73 | ALDH1A1 (0.47) | RAB9ANPC1MEN1KMT2AALDH1A1 | |
| SCHEMBL668404 | 0.73 | MEN1 (0.47) | RAB9AMEN1KMT2AALDH1A1CYP2D6 | |
| SCHEMBL669387 | 0.73 | GRM2 (0.53) | MEN1KMT2AALDH1A1BCHEACHE |
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-2003037271-A2 | COMPOUNDS, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREFOR | MILLENNIUM PHARMACEUTICALS,INC. (US) | 2003-05-08 | — | — | WO | disclosed |