Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | GAPDH | P04406 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5242878 | 0.93 | SMN1; SMN2 (0.50) | SIGMAR1MAOBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL20689749 | 0.91 | MAOB (0.57) | SIGMAR1MAOBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL6561248 | 0.86 | TAAR1 (0.48) | MAOBSMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL10484395 | 0.84 | TAAR1 (0.58) | MAOBSMN1; SMN2NPC1RAB9ATAAR1 | |
| SCHEMBL11766770 | 0.83 | MAOB (0.66) | MAOBSMN1; SMN2ALDH1A1MAPTMEN1 | |
| SCHEMBL22067943 | 0.83 | TAAR1 (0.50) | SIGMAR1MAOBSMN1; SMN2NPC1RAB9A | |
| SCHEMBL270626 | 0.82 | TAAR1 (0.57) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL2734280 | 0.82 | TAAR1 (0.57) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL272341 | 0.82 | TAAR1 (0.57) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL271466 | 0.82 | TAAR1 (0.57) | SMN1; SMN2NPC1RAB9AALDH1A1MAPT |
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-6187958-B1 | A LONG-CHAIN ALKYL OR ALKENYL AMINE WITH A DITHOL GROUP OR MONOTHIOL GROUP IN THE MOLECULE THEREOF AND WHICH SHOW A HIGH REACTIVITY; A REACTION PRODUCT OF ETHYLENE SULFIDE AND FATTY AMINE; USEFUL AS INTERMEDIATES FOR SYNTHESIS | NIPPON SHOKUBAI CO., LTD (JP) | 2001-02-13 | — | — | US | disclosed |