Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.42 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GBA2 | Q9HCG7 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28347671 | 0.98 | ALDH1A1 (0.50) | ALDH1A1TDP1MEN1THRBHTT | |
| SCHEMBL20394647 | 0.95 | SMN1; SMN2 (0.47) | ALDH1A1TDP1MEN1THRBHTT | |
| SCHEMBL28344745 | 0.92 | MEN1 (0.59) | ALDH1A1TDP1MEN1THRBHTT | |
| Hexane SCHEMBL151108 | 0.91 | EPHX1 (0.50) | ALDH1A1TDP1KMT2AEPHX1SMN1; SMN2 | |
| SCHEMBL27982620 | 0.89 | PDK1 (0.38) | ALDH1A1TDP1HTTKMT2AMAPT | |
| Dodecanol SCHEMBL11857644 | 0.84 | EPHX1 (0.48) | ALDH1A1TDP1MEN1KMT2AEPHX1 | |
| Hexane SCHEMBL28046900 | 0.84 | EPHX1 (0.44) | ALDH1A1HTTKMT2AEPHX1SMN1; SMN2 | |
| 1-Hexanol SCHEMBL11445517 | 0.84 | EPHX1 (0.48) | ALDH1A1TDP1MEN1KMT2AEPHX1 | |
| SCHEMBL2700383 | 0.82 | ALDH1A1 (0.65) | ALDH1A1TDP1EPHX1SMN1; SMN2PDK1 | |
| Ether SCHEMBL11356666 | 0.82 | POLB (0.40) | ALDH1A1TDP1MEN1HTTKMT2A |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104098743-B | A kind of random butylbenzene copolymer of multi-arm star of wide distribution polyisocyanates coupling and preparation method thereof | 中国石油化工股份有限公司 | 2017-07-14 | — | — | CN | claimed |
| CN-103804603-B | The application of a kind of solution polymerized butadiene styrene rubber and synthetic method and acid anhydrides | SINOPEC CORP. (CN) | 2016-03-02 | — | — | CN | claimed |
| CN-104098743-A | Wide-distribution polyisocyanate-coupled multi-arm star random butadiene-styrene copolymer and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2014-10-15 | — | — | CN | claimed |
| CN-103804603-A | Solution polymerized styrene-butadiene rubber, synthetic method thereof, and applications of acid anhydride | CHINA PETROLEUM & CHEMICAL | 2014-05-21 | — | — | CN | claimed |
| CN-104098743-B | A kind of random butylbenzene copolymer of multi-arm star of wide distribution polyisocyanates coupling and preparation method thereof | 中国石油化工股份有限公司 | 2017-07-14 | — | — | CN | disclosed |
| CN-103804603-B | The application of a kind of solution polymerized butadiene styrene rubber and synthetic method and acid anhydrides | SINOPEC CORP. (CN) | 2016-03-02 | — | — | CN | disclosed |
| CN-104098743-A | Wide-distribution polyisocyanate-coupled multi-arm star random butadiene-styrene copolymer and preparation method thereof | CHINA PETROLEUM & CHEMICAL | 2014-10-15 | — | — | CN | disclosed |
| CN-103804603-A | Solution polymerized styrene-butadiene rubber, synthetic method thereof, and applications of acid anhydride | CHINA PETROLEUM & CHEMICAL | 2014-05-21 | — | — | CN | disclosed |