Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 5/20 | 0.84 |
| ▸ | ERCC5 | P28715 | 5/20 | 0.65 |
| ▸ | FEN1 | P39748 | 5/20 | 0.65 |
| ▸ | F10 | P00742 | 1/20 | 0.57 |
| ▸ | MRGPRX4 | Q96LA9 | 5/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.56 |
| ▸ | PTPRC | P08575 | 1/20 | 0.55 |
| ▸ | TP53 | P04637 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 2/20 | 0.55 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.55 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.55 |
| ▸ | RELA | Q04206 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.54 |
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6951340 | 0.91 | PTPN1 (1.00) | PTPN1ERCC5FEN1NR4A2SMPD1 | |
| SCHEMBL11683646 | 0.84 | PTPN1 (0.72) | PTPN1ERCC5FEN1NR4A2PTPRC | |
| SCHEMBL4935528 | 0.82 | PTPN1 (0.79) | PTPN1ERCC5FEN1NR4A2SMPD1 | |
| SCHEMBL6946999 | 0.82 | PTPN1 (0.73) | PTPN1ERCC5FEN1MRGPRX4NR4A2 | |
| SCHEMBL4138759 | 0.82 | NR4A2 (0.81) | MRGPRX4NR4A2TP53PKMNFKB1 | |
| SCHEMBL6947534 | 0.81 | PTPN1 (0.81) | PTPN1ERCC5FEN1MRGPRX4NR4A2 | |
| SCHEMBL7196671 | 0.80 | ERCC5 (0.66) | PTPN1ERCC5FEN1SMN1; SMN2RAB9A | |
| SCHEMBL6940911 | 0.80 | PTPN1 (0.72) | PTPN1ERCC5FEN1SMN1; SMN2 | |
| SCHEMBL31130421 | 0.80 | PTPN1 (0.78) | PTPN1ERCC5FEN1MRGPRX4NR4A2 | |
| SCHEMBL6948385 | 0.80 | PTPN1 (0.70) | PTPN1ERCC5FEN1NR4A2SMPD1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | claimed |
| EP-1082121-A4 | HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2003-02-05 | — | — | EP | disclosed |
| US-6380249-B1 | HIV integrase inhibitors | MERCK & CO., INC. | 2002-04-30 | — | — | US | disclosed |
| EP-1082121-A1 | HIV INTEGRASE INHIBITORS | Merck & Co., Inc. (US) | 2001-03-14 | — | — | EP | disclosed |
| WO-1999062520-A1 | HIV INTEGRASE INHIBITORS | MERCK & CO., INC. (US) | 1999-12-09 | — | — | WO | disclosed |