Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.42 |
| ▸ | MIF | P14174 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8042759 | 0.89 | NPC1 (0.43) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8051528 | 0.87 | USP2 (0.45) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8048417 | 0.87 | NPC1 (0.41) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8044457 | 0.86 | HDAC6 (0.57) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8045746 | 0.84 | KMT2A (0.53) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8043654 | 0.82 | TSHR (0.52) | KMT2AMEN1TSHRALDH1A1CYP3A4 | |
| SCHEMBL8038005 | 0.81 | NPSR1 (0.56) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8051531 | 0.81 | ALDH1A1 (0.45) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8032454 | 0.80 | TSHR (0.49) | KMT2AMEN1TSHRNPC1RAB9A | |
| SCHEMBL8044858 | 0.79 | TSHR (0.49) | KMT2AMEN1TSHRNPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |