Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO2 | P16083 | 5/20 | 0.47 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.46 |
| ▸ | RELA | Q04206 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | G6PD | P11413 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8055017 | 0.79 | HTT (0.49) | NQO2RAB9ANPC1SMN1; SMN2TP53 | |
| SCHEMBL659152 | 0.77 | HTT (0.40) | NQO2RAB9ANPC1SMN1; SMN2TP53 | |
| SCHEMBL8040045 | 0.77 | NQO2 (0.47) | NQO2RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL2138255 | 0.76 | MEN1 (0.62) | NQO2RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL84829 | 0.75 | CYP3A4 (0.57) | NQO2RAB9ANPC1HPGDMAPT | |
| SCHEMBL2748734 | 0.75 | NQO2 (0.46) | NQO2RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL2749006 | 0.75 | ALDH1A1 (0.58) | NQO2RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL6901949 | 0.74 | HSP90AA1 (0.48) | NQO2RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL6691814 | 0.74 | ALDH1A1 (0.47) | NQO2RAB9ANPC1SMN1; SMN2HPGD | |
| SCHEMBL8052343 | 0.72 | NPC1 (0.48) | NQO2RAB9ANPC1SMN1; SMN2HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-6130217-A | ANTITUMOR | PFIZER INC (US) | 2000-10-10 | — | — | US | disclosed |
| WO-1994022846-A1 | COMPOUNDS ENHANCING ANTITUMOR ACTIVITY OF OTHER CYTOTOXIC AGENTS | PFIZER INC. (US) | 1994-10-13 | — | — | WO | disclosed |