Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 4/20 | 0.39 |
| ▸ | NOS1 | P29475 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.39 |
| ▸ | MEN1 | O00255 | 7/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | S100B | P04271 | 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 | |
|---|---|---|---|---|
| SCHEMBL8607892 | 0.81 | NOS3 (0.36) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL9112452 | 0.81 | NOS3 (0.36) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| Bromide SCHEMBL7703398 | 0.79 | NOS3 (0.38) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL7624072 | 0.79 | KMT2A (0.35) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL8603549 | 0.77 | ALDH1A1 (0.33) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL10031422 | 0.73 | NOS3 (0.36) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL242948 | 0.72 | S100B (0.52) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL242949 | 0.72 | S100B (0.52) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL13754812 | 0.72 | S100B (0.52) | NOS3NOS1ALDH1A1KMT2AMEN1 | |
| SCHEMBL10064354 | 0.72 | NOS1 (0.39) | NOS3NOS1ALDH1A1KMT2AMEN1 |
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-8742076-B2 | Nemorubicin metabolite and analog reagents, antibody-drug conjugates and methods | GENENTECH, INC. (US) | 2014-06-03 | — | — | US | disclosed |
| US-7858794-B2 | Tetrahydroquinoline derivatives | N.V. ORGANON (NL) | 2010-12-28 | — | — | US | disclosed |