Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA3 | P07451 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | BRD2 | P25440 | 1/20 | 0.31 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.30 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16421826 | 0.78 | BRD4 (0.37) | TDP1ALDH1A1MAPTBRD4BRD2 | |
| SCHEMBL12052851 | 0.76 | ALDH1A1 (0.36) | TDP1ALDH1A1LMNACA12CA1 | |
| SCHEMBL10491078 | 0.76 | P2RX7 (0.37) | TDP1ALDH1A1 | |
| SCHEMBL27326395 | 0.74 | PIK3CD (0.36) | TDP1ALDH1A1LMNACA12CA1 | |
| SCHEMBL152534 | 0.74 | ALDH1A1 (0.36) | TDP1ALDH1A1MAPTBRD4BRD2 | |
| SCHEMBL29050076 | 0.73 | TDP1 (0.34) | TDP1ALDH1A1MAPT | |
| SCHEMBL24050561 | 0.71 | KMT2A (0.36) | ALDH1A1CA1CA2CA4MAPT | |
| SCHEMBL22114528 | 0.69 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL867620 | 0.69 | ALDH1A1 (0.35) | ALDH1A1CA1CA2CA4MAPT | |
| SCHEMBL11152204 | 0.67 | CA1 (0.34) | TDP1ALDH1A1CA1CA2CA4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0288515-B1 | QUATERNIZED NITROGEN CONTAINING COMPOUNDS | ISP INVESTMENTS INC. (US) | 1993-05-05 | — | — | EP | disclosed |
| EP-0288515-A4 | QUATERNIZED NITROGEN CONTAINING COMPOUNDS | — | 1990-09-26 | — | — | EP | disclosed |
| US-4830850-A | CONDITIONERS, SOFTENERS, PRESERVATIVES | GAF CORPORATION (US) | 1989-05-16 | — | — | US | disclosed |
| EP-0288515-A1 | QUATERNIZED NITROGEN CONTAINING COMPOUNDS. | GAF CORP (US) | 1988-11-02 | — | — | EP | disclosed |
| WO-1988002985-A1 | QUATERNIZED NITROGEN CONTAINING COMPOUNDS | GAF CORPORATION (US) | 1988-05-05 | — | — | WO | disclosed |
| US-4732990-A | BACTERICIDES, HAIR CONDITIONERS | GAF CORPORATION (US) | 1988-03-22 | — | — | US | disclosed |