Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | PANK3 | Q9H999 | 5/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.39 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.39 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10131987 | 0.88 | ESR2 (0.56) | POLBRORCCYP2C9ESR2PANK3 | |
| SCHEMBL10131989 | 0.82 | IKBKE (0.38) | POLBRORCESR2ALDH1A1 | |
| SCHEMBL925698 | 0.82 | CA2 (0.54) | POLBPANK3NPC1RAB9AALDH1A1 | |
| SCHEMBL17316624 | 0.80 | PANK3 (0.45) | RORCCYP2C9ESR2PANK3NPC1 | |
| SCHEMBL31480957 | 0.80 | CA2 (0.55) | CYP2C9PANK3 | |
| SCHEMBL8403545 | 0.80 | POLB (0.61) | POLBALDH1A1LMNA | |
| SCHEMBL925686 | 0.79 | CYP4F2 (0.56) | RORCNPC1RAB9AALDH1A1LMNA | |
| SCHEMBL17065071 | 0.78 | KMO (0.42) | — | |
| SCHEMBL17112134 | 0.77 | CYP4F2 (0.45) | RORCCYP2C9PANK3RAB9AALDH1A1 | |
| SCHEMBL1713575 | 0.77 | CYP4Z1 (0.49) | ESR2ALDH1A1LMNAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008134036-A1 | ALPHA-SUBSTITUTED ARYLMETHYL PIPERAZINE PYRAZOLO[1,5-α]PYRIMIDINE AMIDE DERIVATIVES | PANACOS PHARMACEUTICALS, INC. (US) | 2008-11-06 | — | — | WO | disclosed |
| WO-2008075118-A1 | NOVEL CB1 ANTAGONISTS AND THEIR PREPARATION | RICHTER GEDEON NYRT. (HU) | 2008-06-26 | — | — | WO | disclosed |
| WO-2006060122-A2 | CARDIOTONIC COMPOUNDS WITH INHIBITORY ACTIVITY AGAINST BETA-ADRENERGIC RECEPTORS AND PHOSPHODIESTERASE | ARTESIAN THERAPEUTICS, INC. (US) | 2006-06-08 | — | — | WO | disclosed |