Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CLK1 | P49759 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8044973 | 0.85 | PDK1 (0.45) | ALDH1A1LMNAHTTTSHRSMN1; SMN2 | |
| SCHEMBL8044955 | 0.84 | USP2 (0.48) | ALDH1A1LMNAHTTTSHRSMN1; SMN2 | |
| SCHEMBL8043499 | 0.84 | L3MBTL1 (0.41) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8043226 | 0.84 | ALDH1A1 (0.48) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8051920 | 0.82 | TSHR (0.51) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8051273 | 0.80 | TSHR (0.42) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8045522 | 0.80 | PKM (0.44) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8046376 | 0.80 | SMN1; SMN2 (0.41) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8032457 | 0.79 | TSHR (0.41) | ALDH1A1LMNAHTTHPGDTSHR | |
| SCHEMBL8044199 | 0.79 | TSHR (0.41) | ALDH1A1LMNAHTTHPGDTSHR |
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 |