Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.56 |
| ▸ | TACR1 | P25103 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RIPK1 | Q13546 | 3/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.44 |
| ▸ | PAK4 | O96013 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13485746 | 0.89 | HSP90AA1 (0.55) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL13485747 | 0.88 | HSP90AA1 (0.54) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL5104857 | 0.87 | HSP90AA1 (0.59) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL16510056 | 0.86 | POLB (0.60) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL16268556 | 0.81 | HSP90AA1 (0.53) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL14646676 | 0.77 | TACR1 (0.59) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL21732983 | 0.75 | HSP90AA1 (0.50) | HSP90AA1TACR1RAB9ANPC1POLB | |
| SCHEMBL4300077 | 0.74 | CHRNB2 (0.58) | HSP90AA1RAB9AP2RX7CHRNB2CHRNB4 | |
| SCHEMBL24365000 | 0.74 | RIPK1 (0.63) | HSP90AA1RIPK1CHRNB2CHRNB4CHRNA3 | |
| SCHEMBL18286135 | 0.74 | HSP90AA1 (0.52) | HSP90AA1TACR1RAB9ANPC1P2RX7 |
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-2007144409-A1 | STEREOSELECTIVE SYNTHESIS OF (S)-1-METHYL-3-PHENYLPIPERAZINE | N.V. ORGANON (NL) | 2007-12-21 | — | — | WO | disclosed |