Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | ACACB | O00763 | 1/20 | 0.51 |
| ▸ | ACACA | Q13085 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 8/20 | 0.50 |
| ▸ | NPC1 | O15118 | 7/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.49 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL26480230 | 0.93 | CYP2C9 (0.59) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| SCHEMBL24995245 | 0.85 | ALDH1A1 (0.57) | CYP2C19CYP2C9RAB9ANPC1SMN1; SMN2 | |
| SCHEMBL21125363 | 0.83 | L3MBTL1 (0.46) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| SCHEMBL25493962 | 0.83 | L3MBTL1 (0.46) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| SCHEMBL17721292 | 0.83 | RAB9A (0.47) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| Hydrochloric Acid SCHEMBL21531561 | 0.81 | RAB9A (0.46) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| SCHEMBL28131880 | 0.81 | ACACB (0.61) | CYP2C19CYP2C9CYP19A1ACACBACACA | |
| SCHEMBL21787229 | 0.79 | CDK5 (0.46) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| SCHEMBL25671670 | 0.79 | CDK5 (0.46) | CYP2C19CYP2C9CYP19A1RAB9ANPC1 | |
| SCHEMBL12628171 | 0.79 | ACACB (0.55) | CYP2C19CYP2C9CYP19A1ACACBACACA |
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-2018045245-A1 | CYCLIC PEPTIDE ANALOGS AND CONJUGATES THEREOF | SIRENAS LLC (US) | 2018-03-08 | — | — | WO | disclosed |