Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.35 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.35 |
| ▸ | EGLN2 | Q96KS0 | 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 | |
|---|---|---|---|---|
| SCHEMBL30642911 | 0.81 | NOTUM (0.42) | TAAR1ESR2IDO1NOTUMKDM4E | |
| SCHEMBL8042855 | 0.78 | ALDH1A1 (0.45) | IDO1RXFP1APOBEC3GKDM4ECHRNB4 | |
| SCHEMBL8041917 | 0.77 | CTSS (0.44) | IDO1NOTUMKDM4E | |
| SCHEMBL8033685 | 0.71 | LMNA (0.48) | IDO1MEN1MAPTKMT2A | |
| SCHEMBL8042792 | 0.70 | KMO (0.34) | IDO1KDM4EMEN1KMT2ACYP3A4 | |
| SCHEMBL198702 | 0.70 | TAAR1 (0.68) | TAAR1ESR2IDO1NOTUMKDM4E | |
| SCHEMBL4146528 | 0.69 | TAAR1 (0.42) | TAAR1ESR2IDO1NOTUMKDM4E | |
| SCHEMBL16605628 | 0.67 | TAAR1 (0.65) | TAAR1ESR2IDO1NOTUMKDM4E | |
| SCHEMBL29628985 | 0.67 | TAAR1 (0.65) | TAAR1ESR2IDO1NOTUMKDM4E | |
| SCHEMBL16605626 | 0.67 | TAAR1 (0.65) | TAAR1ESR2IDO1NOTUMKDM4E |
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 |