Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA5A | P35218 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8625077 | 0.75 | CA1 (0.44) | CA1CA2CA5ACA9ALDH1A1 | |
| SCHEMBL11456801 | 0.69 | CYP1A2 (0.39) | RAB9AALDH1A1TSHRCYP1A2CYP2D6 | |
| SCHEMBL27391523 | 0.68 | ALDH1A1 (0.37) | RAB9AALDH1A1TSHRCYP1A2CYP2D6 | |
| SCHEMBL2857689 | 0.65 | ALDH1A1 (0.39) | ALDH1A1TSHRCYP1A2CYP2D6KMT2A | |
| SCHEMBL8646916 | 0.64 | CA1 (0.47) | CA1CA2CA5ACA9ALDH1A1 | |
| SCHEMBL25373713 | 0.64 | CES1 (0.46) | RAB9AALDH1A1TSHRCYP1A2CYP2D6 | |
| SCHEMBL2814678 | 0.64 | CES1 (0.46) | RAB9AALDH1A1TSHRCYP1A2CYP2D6 | |
| SCHEMBL6892118 | 0.63 | ALDH1A1 (0.51) | RAB9AALDH1A1TSHRCYP1A2CYP2D6 | |
| SCHEMBL5700090 | 0.63 | NR3C2 (0.41) | CA1CA2CA5ACA9ALDH1A1 | |
| SCHEMBL17443045 | 0.62 | KIF11 (0.41) | ALDH1A1TSHRKMT2ACHRM2CHRM1 |
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-0846119-A1 | THIENOPYRIMIDINE DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1998-06-10 | — | — | EP | disclosed |
| WO-1997007119-A1 | THIENOPYRIMIDINE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-02-27 | — | — | WO | disclosed |