Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.67 |
| ▸ | MMP1 | P03956 | 3/20 | 0.58 |
| ▸ | MMP9 | P14780 | 3/20 | 0.58 |
| ▸ | MMP13 | P45452 | 3/20 | 0.58 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | FAAH | O00519 | 3/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | ACHE | P22303 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.51 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL21465972 | 0.81 | HSD11B1 (0.54) | SIGMAR1CYP2D6MEN1POLBKMT2A | |
| SCHEMBL5862230 | 0.80 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL5149023 | 0.80 | DPP4 (0.58) | SIGMAR1CYP2D6TSHRMCHR1POLB | |
| SCHEMBL1991966 | 0.79 | CYP2D6 (0.59) | SIGMAR1CYP2D6TSHRMCHR1POLB | |
| SCHEMBL20068820 | 0.79 | NPC1 (0.51) | SIGMAR1MCHR1MEN1KMT2ANPC1 | |
| SCHEMBL17033023 | 0.78 | MEN1 (0.53) | SIGMAR1MEN1POLBKMT2AALDH1A1 | |
| SCHEMBL5862047 | 0.78 | HTT (0.55) | CYP2D6MEN1KMT2ANPC1ALDH1A1 | |
| SCHEMBL20147687 | 0.78 | CNR2 (0.48) | SIGMAR1CYP2D6POLBALDH1A1MAPT | |
| Hydrochloric Acid SCHEMBL8416135 | 0.77 | CYP2D6 (0.58) | SIGMAR1CYP2D6TSHRMCHR1MEN1 | |
| SCHEMBL28664079 | 0.77 | MAPT (0.53) | SIGMAR1MMP1MMP9CYP2D6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7041667-B1 | CCR5 modulators | PFIZER, INC. (US) | 2006-05-09 | — | — | US | disclosed |
| EP-1013276-A1 | Aminoazacycloalkanes as CCR5 modulators | PFIZER INC. (US) | 2000-06-28 | — | — | EP | disclosed |