Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.39 |
| ▸ | CA7 | P43166 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 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 | |
|---|---|---|---|---|
| Propane SCHEMBL29021125 | 0.86 | ALDH1A1 (0.45) | HPGDCA2CA1CA12CA14 | |
| Catechol SCHEMBL5431374 | 0.84 | CA2 (0.56) | HPGDCA2CA1CA12CA14 | |
| Catechol SCHEMBL27085 | 0.84 | CA2 (0.56) | HPGDCA2CA1CA12CA14 | |
| Methoxymethane SCHEMBL632535 | 0.81 | CA2 (0.48) | HPGDCA2CA1CA12CA14 | |
| SCHEMBL3440828 | 0.81 | ALDH1A1 (0.56) | HPGDHTTCA2CA1CA12 | |
| SCHEMBL15059320 | 0.81 | — | — | |
| SCHEMBL49313 | 0.81 | — | — | |
| SCHEMBL29573828 | 0.81 | — | — | |
| Pentane SCHEMBL27873627 | 0.80 | TSHR (0.42) | HPGDHTTCA2CA12CA14 | |
| Catechol SCHEMBL9616729 | 0.79 | CA2 (0.50) | HPGDCA2CA1CA12CA14 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2049756-A | — | — | None | — | — | JP | disclosed |
| JP-3056451-A | — | — | None | — | — | JP | disclosed |
| JP-H0356451-A | NOVEL DIPHENYLAMINE DERIVATIVE AND PRODUCTION THEREOF | MITSUI TOATSU CHEM INC | 1991-03-12 | — | — | JP | disclosed |
| JP-H0249756-A | PRODUCTION OF DIPHENYLAMINE DERIVATIVE | MITSUI TOATSU CHEM INC | 1990-02-20 | — | — | JP | disclosed |