Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | APEX1 | P27695 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.44 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9083240 | 0.70 | GABRA1 (0.52) | KDM4ENPC1ALDH1A1LMNACYP1A2 | |
| SCHEMBL9386471 | 0.69 | KMT2A (0.47) | KDM4EALDH1A1MAPTHPGDGABRA1 | |
| SCHEMBL30232368 | 0.65 | ALDH1A1 (1.00) | KDM4ENPC1ALDH1A1LMNATP53 | |
| SCHEMBL194445 | 0.65 | ALDH1A1 (1.00) | KDM4ENPC1ALDH1A1LMNATP53 | |
| SCHEMBL29425001 | 0.65 | ALDH1A1 (1.00) | KDM4ENPC1ALDH1A1LMNATP53 | |
| SCHEMBL2953007 | 0.65 | GABRA1 (0.56) | KDM4ENPC1ALDH1A1LMNACYP1A2 | |
| SCHEMBL2945211 | 0.64 | GABRA1 (0.60) | KDM4ENPC1ALDH1A1LMNACYP1A2 | |
| SCHEMBL5251138 | 0.63 | KDM4E (0.38) | KDM4ENPC1ALDH1A1LMNATP53 | |
| SCHEMBL30753126 | 0.63 | MEN1 (0.49) | ALDH1A1MEN1KMT2A | |
| SCHEMBL2951128 | 0.62 | GABRA1 (0.57) | KDM4ENPC1ALDH1A1LMNACYP1A2 |
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 |