Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.63 |
| ▸ | CNR2 | P34972 | 1/20 | 0.63 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.60 |
| ▸ | PIP4K2B | P78356 | 1/20 | 0.60 |
| ▸ | FYN | P06241 | 4/20 | 0.58 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.58 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.58 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.58 |
| ▸ | BRAF | P15056 | 2/20 | 0.56 |
| ▸ | NQO2 | P16083 | 2/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | STAT1 | P42224 | 1/20 | 0.55 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.54 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11222723 | 0.86 | CNR1 (0.64) | CNR1PIP4K2APIP4K2BFYNCYP17A1 | |
| SCHEMBL2183682 | 0.83 | CYP3A4 (0.62) | CNR1CNR2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10663620 | 0.82 | CYP17A1 (0.76) | CNR1PIP4K2APIP4K2BFYNCYP17A1 | |
| SCHEMBL4189391 | 0.82 | PIP4K2A (0.62) | PIP4K2APIP4K2BFYNCYP17A1CYP11B1 | |
| SCHEMBL3786463 | 0.81 | NQO2 (0.73) | CNR1CYP17A1CYP11B1CYP11B2NQO2 | |
| SCHEMBL4191864 | 0.81 | BRAF (0.70) | PIP4K2APIP4K2BFYNCYP17A1CYP11B1 | |
| SCHEMBL8577619 | 0.80 | SMN1; SMN2 (0.70) | CNR1PIP4K2APIP4K2BCYP17A1CYP11B1 | |
| SCHEMBL30339454 | 0.80 | SMN1; SMN2 (0.70) | PIP4K2APIP4K2BCYP17A1NPC1RAB9A | |
| SCHEMBL2648798 | 0.79 | FYN (0.54) | PIP4K2APIP4K2BFYNCYP17A1CYP11B1 | |
| SCHEMBL17742694 | 0.78 | MKNK2 (0.55) | CNR1CNR2FYNMAP4K4ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007130743-A2 | CAPREOMYCIN DERIVATIVES AND THEIR USE AS ANTIBACTERIALS | ARRAY BIOPHARMA, INC. (US) | 2007-11-15 | — | — | WO | disclosed |
| EP-0821683-B1 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A RECEPTOR COMPLEX | NEUROSEARCH AS (DK) | 2006-11-02 | — | — | EP | disclosed |
| US-5902813-A | MODULATORS OF THE BENZODIAXEPINE RECEPTOR OT THE GAMMA-BUTYRIC ACID(A) RECEPTOR COMPLEX; ANXIOLYTIC, ANTIEPILEPTIC AND -CONVULSANT AGENTS; SLEEP AND MEMORY DISORDERS | NEUROSEARCH A/S (DK) | 1999-05-11 | — | — | US | disclosed |
| EP-0821683-A1 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABA A? RECEPTOR COMPLEX | NEUROSEARCH A/S (DK) | 1998-02-04 | — | — | EP | disclosed |
| WO-1996033192-A1 | BENZIMIDAZOLE COMPOUNDS AND THEIR USE AS MODULATORS OF THE GABAA RECEPTOR COMPLEX | NEUROSEARCH A/S (DK) | 1996-10-24 | — | — | WO | disclosed |