Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.69 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.69 |
| ▸ | TSHR | P16473 | 4/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.69 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.69 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.69 |
| ▸ | MAOA | P21397 | 2/20 | 0.68 |
| ▸ | MAPT | P10636 | 2/20 | 0.66 |
| ▸ | NPC1 | O15118 | 2/20 | 0.66 |
| ▸ | RAB9A | P51151 | 2/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.59 |
| ▸ | SCN1A | P35498 | 2/20 | 0.59 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.59 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.59 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL10301415 | 0.83 | NPC1 (0.68) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| SCHEMBL3438967 | 0.83 | NPC1 (0.63) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| Butamben SCHEMBL81735 | 0.82 | LMNA (1.00) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| SCHEMBL561945 | 0.82 | NPC1 (0.80) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| SCHEMBL48450 | 0.82 | LMNA (0.79) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| Benzocaine SCHEMBL25100 | 0.82 | LMNA (1.00) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| Benzocaine SCHEMBL1235972 | 0.82 | LMNA (1.00) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| SCHEMBL3267566 | 0.81 | BRD4 (0.54) | LMNACYP1A2TSHRCYP3A4MAOA | |
| SCHEMBL11375136 | 0.81 | LMNA (0.77) | LMNACYP1A2TSHRCYP3A4CYP2C19 | |
| SCHEMBL769120 | 0.81 | ALDH1A1 (0.97) | LMNACYP1A2TSHRCYP3A4CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0973389-A4 | NITROGEN-CONTAINING OXYALKYLENE ESTERS AND USES THEREOF | UNIV BAR ILAN (IL) | 2001-01-24 | — | — | EP | disclosed |
| EP-0973389-A1 | NITROGEN-CONTAINING OXYALKYLENE ESTERS AND USES THEREOF | BAR-ILAN UNIVERSITY (IL) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998039966-A1 | NITROGEN-CONTAINING OXYALKYLENE ESTERS AND USES THEREOF | BAR-ILAN UNIVERSITY (IL) | 1998-09-17 | — | — | WO | disclosed |