Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGER1 | P34995 | 3/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 10/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.41 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5372921 | 0.99 | PTGDR2 (0.41) | PTGER1PTGDR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4805917 | 0.82 | PTGER1 (0.40) | PTGER1PTGDR2CYP2C19PPARGMEN1 | |
| SCHEMBL2948464 | 0.76 | F2RL3 (0.41) | PTGER1PTGDR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4808924 | 0.75 | PTGER1 (0.42) | PTGER1PTGDR2CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4804162 | 0.74 | FSCN1 (0.40) | PTGDR2PPARGMEN1KMT2A | |
| SCHEMBL4803688 | 0.73 | FSCN1 (0.39) | PTGDR2PPARGMEN1KMT2A | |
| SCHEMBL4805488 | 0.73 | FSCN1 (0.39) | PTGDR2PPARGMEN1KMT2A | |
| SCHEMBL4804543 | 0.73 | FSCN1 (0.39) | PTGDR2PPARGMEN1KMT2A | |
| SCHEMBL4804042 | 0.73 | FSCN1 (0.37) | PTGER1PTGDR2CYP2C19PPARGMEN1 | |
| SCHEMBL4806883 | 0.72 | MMP13 (0.42) | PPARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1756103-A2 | PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS HIV-INTEGRASE INHIBITORS | Pfizer, Inc. (US) | 2007-02-28 | — | — | EP | disclosed |
| WO-2005103003-A2 | PYRROLOPYRIDINE DERIVATIVES AND THEIR USE AS HIV-INTEGRASE INHIBITORS | PFIZER INC. (US) | 2005-11-03 | — | — | WO | disclosed |