Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TOP2A | P11388 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | PRNP | P04156 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6498960 | 0.89 | HSD17B10 (0.50) | HSD17B10TSHRUSP2MAPK1KDM4E | |
| SCHEMBL15800529 | 0.87 | HSD17B10 (0.54) | HSD17B10TSHRUSP2MAPK1KDM4E | |
| SCHEMBL10157228 | 0.85 | HSD17B10 (0.52) | HSD17B10TSHRUSP2MAPK1KDM4E | |
| SCHEMBL10157232 | 0.85 | KDM4E (0.56) | HSD17B10TSHRUSP2MAPK1KDM4E | |
| SCHEMBL12630087 | 0.82 | SMN1; SMN2 (0.51) | HSD17B10KDM4ESMN1; SMN2POLBTDP1 | |
| SCHEMBL6818967 | 0.79 | GPR3 (0.50) | HSD17B10MAPK1KDM4ESMN1; SMN2POLB | |
| SCHEMBL538291 | 0.77 | SMN1; SMN2 (0.69) | HSD17B10TSHRKDM4ESMN1; SMN2NPSR1 | |
| SCHEMBL32659735 | 0.76 | ALDH1A1 (0.61) | HSD17B10MAPK1KDM4ESMN1; SMN2POLB | |
| SCHEMBL3906503 | 0.75 | SMN1; SMN2 (0.67) | KDM4ESMN1; SMN2POLBNPSR1KMT2A | |
| SCHEMBL26598060 | 0.74 | PKM (0.54) | HSD17B10TSHRKDM4ESMN1; SMN2POLB |
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-2019825-B9 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | BOEHRINGER INGELHEIM INT (DE) | 2011-01-26 | — | — | EP | disclosed |
| EP-2019825-B1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | BOEHRINGER INGELHEIM INT (DE) | 2010-09-01 | — | — | EP | disclosed |
| WO-2007131350-A1 | INHIBITORS OF HUMAN IMMUNODEFICIENCY VIRUS REPLICATION | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-11-22 | — | — | WO | disclosed |