Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 4/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MET | P08581 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6655650 | 0.88 | KMT2A (0.43) | KMT2AMEN1THRBVCAM1MAPT | |
| SCHEMBL6378830 | 0.83 | CASP6 (0.53) | POLBLMNA | |
| SCHEMBL6948552 | 0.82 | KMT2A (0.44) | KMT2AMEN1THRBVCAM1MAPT | |
| SCHEMBL7450087 | 0.81 | PDK1 (0.42) | KMT2ATHRBVCAM1MAPTALDH1A1 | |
| SCHEMBL7613643 | 0.81 | ESR1 (0.49) | KMT2AMEN1THRBMAPTALDH1A1 | |
| SCHEMBL6378448 | 0.80 | KMT2A (0.44) | KMT2AMEN1VCAM1MAPTALDH1A1 | |
| SCHEMBL6378524 | 0.78 | VCAM1 (0.43) | KMT2AMEN1VCAM1MAPTALDH1A1 | |
| SCHEMBL11247732 | 0.77 | CASP6 (0.57) | KMT2AVCAM1MAPTALDH1A1NPC1 | |
| SCHEMBL8329755 | 0.76 | KMT2A (0.40) | KMT2AMEN1THRBVCAM1MAPT | |
| SCHEMBL8326945 | 0.76 | KMT2A (0.40) | KMT2AMEN1THRBVCAM1MAPT |
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-1225895-B1 | FAB I INHIBITORS | AFFINIUM PHARM INC (CA) | 2005-05-04 | — | — | EP | disclosed |
| US-6762201-B1 | SUCH AS N-((2-AMINO-5-(N-METHYL-N-((1-METHYLINDOL-2-YL) -METHYL)CARBAMOYL)PHENYL)METHYL)-N-METHYLACETAMIDE; BACTERIAL INFECTIONS | AFFINIUM PHARMACEUTICALS, INC. (CA) | 2004-07-13 | — | — | US | disclosed |