Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | THRA | P10827 | 1/20 | 0.54 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL3814415 | 0.91 | THRA (0.59) | KMT2AMEN1THRATHRBTSHR | |
| SCHEMBL14331174 | 0.88 | KMT2A (0.64) | KMT2AMEN1SMN1; SMN2THRATHRB | |
| SCHEMBL14407242 | 0.84 | KMT2A (0.53) | KMT2ASMN1; SMN2MAPTTHRATHRB | |
| SCHEMBL1545306 | 0.84 | KMT2A (0.66) | KMT2AMEN1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL27338025 | 0.84 | MEN1 (0.66) | KMT2AMEN1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL8795459 | 0.84 | CTNNB1 (0.62) | KMT2AMEN1KDM4ECYP1A2CYP3A4 | |
| SCHEMBL4344594 | 0.84 | HSD17B2 (0.56) | KMT2AMEN1SMN1; SMN2NPC1RAB9A | |
| SCHEMBL3814029 | 0.83 | TSHR (0.44) | KMT2ATHRATHRBTSHRMAPK1 | |
| SCHEMBL1498715 | 0.82 | KMT2A (0.68) | KMT2AMEN1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL27816792 | 0.82 | MEN1 (0.68) | KMT2AMEN1KDM4ESMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018057941-A1 | MOLECULAR LOGIC GATES FOR CONTROLLED MATERIAL DEGRADATION | UNIVERSITY OF WASHINGTON (US) | 2018-03-29 | — | — | WO | disclosed |